data_2c7h_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 2c7h _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 N--CA 1.413 -2.32 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.543 ' SG ' HG21 ' A' ' 23' ' ' THR . 58.0 m -125.86 128.93 48.38 Favored 'General case' 0 C--N 1.291 -1.945 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.195 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.431 ' O ' ' HA ' ' A' ' 21' ' ' THR . 25.3 t -108.11 124.66 64.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.853 175.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -81.29 105.98 12.91 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.03 -0.987 . . . . 0.0 108.377 173.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.567 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.0 p90 -118.6 126.01 51.03 Favored 'General case' 0 C--N 1.278 -2.535 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.14 133.07 50.53 Favored 'General case' 0 C--N 1.278 -2.515 0 C-N-CA 118.536 -1.265 . . . . 0.0 107.688 176.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -82.93 150.52 26.39 Favored 'General case' 0 C--N 1.282 -2.333 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 p -64.43 -24.79 67.75 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.43 0.633 . . . . 0.0 110.648 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 m -80.47 -15.59 56.39 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.861 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.433 ' HB3' ' OD1' ' A' ' 18' ' ' ASN . 82.3 mttt -104.44 157.78 16.93 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.82 0.819 . . . . 0.0 112.492 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -96.74 1.24 50.68 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.054 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' A' ' 16' ' ' LYS . 30.3 p-10 -145.6 164.91 30.25 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.787 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -91.82 139.4 30.71 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.04 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.17 177.62 4.75 Favored 'General case' 0 C--N 1.279 -2.46 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -144.26 120.83 11.08 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -172.198 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.42 HG12 ' CE1' ' A' ' 11' ' ' TYR . 1.9 m -95.23 126.83 47.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.543 HG21 ' SG ' ' A' ' 8' ' ' CYS . 10.8 p -98.93 118.19 35.15 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -131.46 175.59 9.02 Favored 'General case' 0 C--N 1.281 -2.394 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.624 -178.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -107.81 150.34 27.12 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.876 0.735 . . . . 0.0 109.799 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.41 -114.74 4.2 Favored Glycine 0 N--CA 1.42 -2.398 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tt -152.58 -41.08 0.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.52 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -133.49 152.63 51.93 Favored 'General case' 0 CA--C 1.49 -1.364 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.954 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -117.9 127.34 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.574 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.97 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.4 m -63.09 140.29 58.86 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.5 tp -54.64 -39.23 67.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 124.64 1.176 . . . . 0.0 112.561 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.672 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -54.38 -46.91 73.16 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -74.93 -36.86 62.15 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.821 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.9 -47.34 85.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.721 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.7 mtmt -71.69 -44.92 63.37 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.644 -178.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.672 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.2 mptt -61.38 -35.16 76.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.273 -0.422 . . . . 0.0 112.023 -178.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.39 -49.66 62.97 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 120.481 -0.488 . . . . 0.0 109.891 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -64.97 -42.33 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.971 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.518 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 57.4 mtt -59.78 -44.89 93.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.696 0.284 . . . . 0.0 111.237 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.07 -31.01 62.25 Favored Glycine 0 C--N 1.317 -0.491 0 CA-C-O 121.664 0.591 . . . . 0.0 112.058 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.7 ttt85 -69.32 -51.28 38.65 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 123.766 0.826 . . . . 0.0 111.646 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 40.0 mm-40 -92.98 -14.23 27.73 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -172.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp 77.75 72.3 0.06 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 125.657 1.583 . . . . 0.0 111.236 -177.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.422 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.9 mp -101.0 153.85 19.19 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.089 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.538 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.96 101.88 14.23 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.666 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.02 -12.56 59.69 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.443 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.39 -15.71 57.42 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.23 177.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -117.26 -31.31 5.34 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.588 0.709 . . . . 0.0 110.606 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.0 m -129.2 165.25 21.71 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-O 122.295 1.045 . . . . 0.0 113.787 -172.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -123.08 169.66 10.97 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 173.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 35' ' ' LYS . 14.2 tp -115.34 120.09 38.48 Favored 'General case' 0 C--N 1.257 -3.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.484 ' HB2' HG12 ' A' ' 80' ' ' ILE . 7.1 tp-100 -106.49 123.45 48.1 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-O 121.267 0.556 . . . . 0.0 109.604 -176.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.8 mm -114.29 135.43 54.07 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -172.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.5 m -125.89 140.78 52.36 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 9.5 t-20 -72.55 138.22 46.76 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.28 -16.56 34.81 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.436 0.636 . . . . 0.0 110.723 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -99.17 -44.51 6.24 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.842 -173.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -100.38 -19.08 16.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.191 0.519 . . . . 0.0 110.254 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.9 mmmm 71.96 12.45 6.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.051 1.341 . . . . 0.0 112.155 -177.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.1 135.35 46.22 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.059 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -92.86 145.26 24.53 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.296 0.57 . . . . 0.0 110.544 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -105.18 98.01 7.77 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -90.56 -37.67 13.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.453 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 11.6 t70 -101.17 150.59 22.79 Favored 'General case' 0 CA--C 1.495 -1.17 0 C-N-CA 120.482 -0.487 . . . . 0.0 109.831 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -64.32 -15.21 59.87 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.453 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -83.08 -11.17 58.25 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.19 141.19 58.32 Favored 'General case' 0 C--O 1.19 -2.038 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.52 HD12 ' CG ' ' A' ' 28' ' ' HIS . 2.8 pp -117.2 137.72 52.17 Favored 'General case' 0 C--N 1.289 -2.065 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.137 -171.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.34 112.53 43.76 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 48.8 Cg_endo -78.0 156.63 30.51 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 C-N-CA 122.803 2.335 . . . . 0.0 112.865 175.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -58.24 -17.5 19.7 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.429 0.692 . . . . 0.0 112.535 178.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -82.71 -1.95 52.8 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.918 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.1 m -115.46 118.61 33.67 Favored 'General case' 0 N--CA 1.424 -1.773 0 O-C-N 122.221 -0.3 . . . . 0.0 111.371 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 m -89.8 123.21 33.58 Favored 'General case' 0 N--CA 1.425 -1.689 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.9 m -121.39 160.03 23.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 CA-C-O 120.945 0.402 . . . . 0.0 111.783 -172.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.7 mm -107.5 133.97 50.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.44 117.75 52.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.444 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -114.46 137.28 52.04 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -92.74 124.64 36.89 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.548 -0.72 . . . . 0.0 109.666 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.484 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -125.89 149.34 65.66 Favored Pre-proline 0 C--O 1.206 -1.202 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.144 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 C--N 1.32 -0.963 0 C-N-CA 122.297 1.998 . . . . 0.0 111.827 178.002 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 73.4 m . . . . . 0 N--CA 1.392 -3.372 0 CA-C-O 121.201 0.524 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.1 p -139.04 135.66 34.46 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.385 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.566 HG22 ' CE1' ' A' ' 24' ' ' PHE . 69.1 t -105.19 129.57 57.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -82.97 115.76 21.95 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.91 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.572 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 51.0 p90 -133.66 142.01 47.85 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -120.25 136.99 54.47 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 118.331 -1.348 . . . . 0.0 108.124 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -83.96 174.63 10.18 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -56.55 -37.31 70.35 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.157 0.583 . . . . 0.0 112.482 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.3 m -90.96 1.68 56.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.185 0.517 . . . . 0.0 111.498 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.411 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 1.4 mptm? -98.13 127.32 44.0 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.496 0.665 . . . . 0.0 111.615 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.8 tp -91.4 -21.65 20.87 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.964 -1.016 . . . . 0.0 108.341 175.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.22 149.11 46.76 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.011 -1.449 . . . . 0.0 108.954 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -78.16 147.2 34.64 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.411 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 28.4 m-20 -101.11 173.87 6.26 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.9 p -136.15 132.35 35.9 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -102.33 126.15 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 169.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.9 p -94.51 129.54 41.26 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.566 ' CE1' HG22 ' A' ' 9' ' ' VAL . 32.3 p90 -145.99 158.68 43.87 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -95.35 132.9 39.88 Favored 'General case' 0 C--N 1.296 -1.752 0 C-N-CA 119.994 -0.683 . . . . 0.0 111.072 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.92 -146.93 17.39 Favored Glycine 0 N--CA 1.437 -1.297 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.37 -41.95 2.58 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.498 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -131.53 152.74 50.49 Favored 'General case' 0 CA--C 1.479 -1.764 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.264 177.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.52 ' HB ' ' CD2' ' A' ' 24' ' ' PHE . 12.4 tt -119.34 126.09 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.732 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.262 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.1 m -55.54 142.31 33.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.445 ' HG ' ' HE2' ' A' ' 35' ' ' LYS . 60.0 tp -58.36 -38.08 76.5 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.749 0.82 . . . . 0.0 112.309 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.676 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 35.6 t -56.18 -46.92 79.18 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 30.3 t70 -69.91 -37.89 76.11 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.291 -174.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.07 -46.53 67.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.781 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.9 mtmt -66.03 -40.06 90.72 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.357 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.676 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -64.02 -35.2 79.93 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 123.552 0.532 . . . . 0.0 111.163 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 94.6 mt-30 -65.0 -47.21 78.33 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.65 -44.73 93.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.258 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.498 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 54.5 mtt -60.12 -43.83 95.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.673 0.273 . . . . 0.0 110.465 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -33.12 73.22 Favored Glycine 0 C--N 1.317 -0.525 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.54 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -70.97 -51.25 26.77 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.988 0.423 . . . . 0.0 111.186 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -84.57 -6.59 59.38 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.427 -172.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 7.6 mmmm 67.03 46.97 1.45 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.6 tp -83.3 115.61 22.06 Favored 'General case' 0 N--CA 1.411 -2.406 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.095 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.562 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.49 109.9 8.35 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-O 121.711 0.767 . . . . 0.0 110.289 177.432 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.31 58.16 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.787 -174.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.91 -1.71 57.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.556 0.694 . . . . 0.0 110.125 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -108.99 -51.65 2.86 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.794 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.7 m -140.01 164.62 29.53 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.446 0.641 . . . . 0.0 111.91 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -108.61 170.57 7.94 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.433 HD12 ' CG1' ' A' ' 77' ' ' VAL . 17.5 tp -118.58 112.5 19.95 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-O 121.334 0.588 . . . . 0.0 109.847 -172.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.404 ' HB2' HG12 ' A' ' 80' ' ' ILE . 19.0 tt0 -101.91 125.67 48.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.431 ' CG1' HD13 ' A' ' 31' ' ' LEU . 44.4 mm -113.21 132.7 61.32 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -126.39 141.24 51.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 122.338 -0.226 . . . . 0.0 110.43 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.428 ' HA ' HG13 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -59.52 124.24 19.43 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 122.856 0.462 . . . . 0.0 110.79 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.88 -28.91 64.89 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.79 -48.21 7.4 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.474 -0.785 . . . . 0.0 112.898 -175.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.9 p -103.83 -8.04 20.07 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.292 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 59.3 25.13 13.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.71 126.17 30.6 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -91.25 137.71 32.15 Favored 'General case' 0 C--N 1.287 -2.109 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.401 ' CD1' ' HB2' ' A' ' 67' ' ' ALA . 72.7 m-85 -103.9 106.61 17.17 Favored 'General case' 0 C--N 1.278 -2.503 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.0 p -101.94 -17.9 15.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.021 -175.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.487 ' HB3' HD21 ' A' ' 66' ' ' ASN . 5.2 t70 -106.18 139.78 40.16 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.201 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -62.75 -16.48 57.93 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 122.886 0.474 . . . . 0.0 111.969 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.487 HD21 ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -77.37 -10.36 59.4 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.472 0.309 . . . . 0.0 111.479 -178.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' A' ' 62' ' ' TYR . . . -69.21 150.22 47.71 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.514 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.498 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -118.86 138.29 52.84 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 118.655 0.661 . . . . 0.0 111.225 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -121.19 117.17 30.73 Favored Pre-proline 0 C--N 1.316 -0.86 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.507 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 58.7 Cg_endo -76.67 154.89 35.13 Favored 'Trans proline' 0 C--N 1.332 -0.293 0 C-N-CA 123.148 2.565 . . . . 0.0 113.66 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.406 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.45 -8.61 55.94 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 122.092 0.949 . . . . 0.0 111.263 178.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -85.18 -1.67 57.16 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.527 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.8 m -119.81 174.58 6.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-O 121.427 0.632 . . . . 0.0 110.947 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.3 m -138.03 139.95 39.86 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.572 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 4.5 m -132.56 161.61 41.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 35.3 mm -106.36 131.84 55.06 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.433 ' CG1' HD12 ' A' ' 51' ' ' LEU . 49.7 t -105.06 117.22 50.34 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.198 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -119.71 121.27 38.84 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 121.569 0.7 . . . . 0.0 110.849 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -81.68 118.64 22.99 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.211 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.59 154.03 66.42 Favored Pre-proline 0 C--O 1.211 -0.946 0 N-CA-C 110.359 -0.237 . . . . 0.0 110.359 -176.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo . . . . . 0 C--N 1.331 -0.388 0 C-N-CA 122.364 2.043 . . . . 0.0 111.733 178.413 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.558 ' O ' ' HA ' ' A' ' 23' ' ' THR . 50.9 m . . . . . 0 N--CA 1.394 -3.249 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.6 p -140.43 136.82 33.44 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.093 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.542 HG22 ' CE1' ' A' ' 24' ' ' PHE . 68.9 t -105.84 128.48 60.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -78.32 113.96 16.79 Favored 'General case' 0 CA--C 1.484 -1.558 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.583 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.3 p90 -135.08 138.38 43.77 Favored 'General case' 0 C--N 1.277 -2.545 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -125.04 136.59 53.83 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 118.615 -1.234 . . . . 0.0 109.788 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -88.59 170.67 10.65 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 179.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.8 p -66.13 -15.68 63.32 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.303 0.573 . . . . 0.0 112.051 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.5 p -94.57 -11.85 28.65 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 123.215 0.606 . . . . 0.0 111.763 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 0.9 OUTLIER -102.73 133.25 48.09 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 120.9 0.381 . . . . 0.0 110.732 -175.171 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.19 -22.82 22.6 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -127.37 170.82 12.11 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -82.37 133.57 35.23 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.541 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 20.2 m-20 -83.98 175.88 9.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 171.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.09 116.07 8.84 Favored 'General case' 0 C--N 1.292 -1.912 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.146 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.584 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -95.21 125.85 47.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.558 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.1 p -93.9 123.88 37.54 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-O 121.592 0.711 . . . . 0.0 112.783 -177.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.542 ' CE1' HG22 ' A' ' 9' ' ' VAL . 22.7 p90 -136.35 176.14 8.96 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -178.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.2 148.7 30.51 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.37 -113.15 3.6 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.785 176.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -148.5 -41.32 0.16 Allowed 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -137.33 155.36 49.51 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.95 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.5 tt -126.56 131.77 70.94 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.593 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.238 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 m -63.52 140.28 58.86 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.4 tp -55.65 -36.68 67.32 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.566 1.146 . . . . 0.0 112.443 -176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.722 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 18.7 t -54.13 -46.86 72.29 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 13.9 t70 -74.38 -37.82 63.33 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -175.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.39 -46.97 85.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.684 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -70.06 -39.88 75.4 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.983 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -65.11 -37.08 86.33 Favored 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.515 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.583 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 89.2 mt-30 -66.36 -45.37 80.39 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.09 -41.06 81.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.911 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.5 mtm -63.95 -37.27 86.79 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.425 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.52 -44.17 41.96 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 120.283 -0.96 . . . . 0.0 111.747 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 25.5 ttt180 -64.84 -49.41 70.68 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' OE2' ' HG2' ' A' ' 41' ' ' ARG . 23.1 mm-40 -92.65 12.99 21.34 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.669 0.271 . . . . 0.0 111.72 -173.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 57.34 47.44 16.64 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.292 1.037 . . . . 0.0 112.166 176.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 mp -81.81 160.89 23.42 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.975 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -96.96 112.43 24.19 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.62 -13.38 58.03 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.06 -13.71 22.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.727 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -113.84 -38.52 4.22 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 121.768 0.794 . . . . 0.0 110.73 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.01 174.63 7.47 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.66 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.43 166.41 17.25 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.474 ' HG ' HD12 ' A' ' 53' ' ' ILE . 28.5 tp -121.85 113.72 20.04 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -111.59 123.61 50.59 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.976 -175.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.474 HD12 ' HG ' ' A' ' 51' ' ' LEU . 2.0 mp -113.41 127.36 70.76 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -173.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.428 ' OG1' ' HG2' ' A' ' 61' ' ' GLU . 29.8 m -122.22 134.57 54.7 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.509 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -62.71 140.16 58.71 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -21.37 41.42 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.232 0.539 . . . . 0.0 111.68 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -101.14 -48.27 4.47 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.712 -176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.5 p -90.74 -20.04 22.86 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.355 0.597 . . . . 0.0 109.855 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.3 mmmt 64.14 24.1 13.35 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.585 1.154 . . . . 0.0 110.928 -177.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -80.52 125.01 29.43 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' HG2' ' OG1' ' A' ' 54' ' ' THR . 44.0 mt-10 -86.12 125.72 33.68 Favored 'General case' 0 N--CA 1.402 -2.839 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.78 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.48 94.74 9.99 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.014 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -88.7 -27.35 21.29 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.954 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.41 ' HB3' HD21 ' A' ' 66' ' ' ASN . 6.1 t70 -102.99 146.9 27.65 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.691 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.528 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -69.15 -14.33 62.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.41 HD21 ' HB3' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -81.6 -10.88 59.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.102 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.81 143.31 57.95 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.422 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.65 137.55 52.57 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 118.705 0.684 . . . . 0.0 110.762 -175.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.29 118.74 35.41 Favored Pre-proline 0 C--N 1.314 -0.958 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.006 176.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 80.4 Cg_endo -82.64 161.03 16.7 Favored 'Trans proline' 0 C--N 1.326 -0.651 0 C-N-CA 123.478 2.785 . . . . 0.0 113.66 176.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.481 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 40.2 pttt -70.05 -5.84 29.46 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.737 0.779 . . . . 0.0 111.203 175.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -87.65 -1.49 57.99 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.045 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -124.42 152.91 42.7 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.971 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.9 m -116.23 133.62 55.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.3 m -127.78 156.13 39.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.506 0.67 . . . . 0.0 112.406 -174.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -101.15 128.67 53.18 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 106.622 -1.621 . . . . 0.0 106.622 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.411 ' CG1' HD12 ' A' ' 51' ' ' LEU . 46.9 t -108.77 115.29 49.03 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -116.52 126.7 53.71 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.46 -174.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -89.82 111.53 22.58 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 pp -111.01 149.99 41.26 Favored Pre-proline 0 C--N 1.297 -1.711 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo . . . . . 0 C--N 1.316 -1.136 0 C-N-CA 121.724 1.616 . . . . 0.0 112.893 -179.319 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 38.6 m . . . . . 0 N--CA 1.412 -2.358 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 64.3 m -139.5 135.45 33.51 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.389 -174.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 21' ' ' THR . 77.5 t -106.82 132.07 55.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -88.1 115.21 25.42 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.596 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 46.0 p90 -130.02 130.9 45.55 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 pttp -109.32 139.22 44.55 Favored 'General case' 0 C--N 1.3 -1.577 0 C-N-CA 116.733 -1.987 . . . . 0.0 107.355 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -84.01 165.9 18.21 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.7 m -69.77 -16.99 63.4 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.325 0.583 . . . . 0.0 110.925 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 p -90.59 -13.06 35.2 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 121.367 0.603 . . . . 0.0 110.274 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -105.45 147.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.447 0.642 . . . . 0.0 111.31 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.7 mp -96.89 -30.79 12.93 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -105.89 163.22 12.91 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.394 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -86.89 142.97 27.64 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.363 0.601 . . . . 0.0 111.789 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -108.53 177.37 4.81 Favored 'General case' 0 C--N 1.288 -2.104 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -143.67 128.05 17.86 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -174.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 1.9 m -95.79 128.61 46.83 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 172.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.416 HG21 ' SG ' ' A' ' 8' ' ' CYS . 21.8 p -94.96 122.41 37.58 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.581 ' O ' ' HB2' ' A' ' 7' ' ' SER . 21.0 p90 -140.49 171.31 14.32 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -177.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -114.06 122.24 46.27 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.51 -172.32 23.07 Favored Glycine 0 N--CA 1.43 -1.709 0 N-CA-C 108.979 -1.648 . . . . 0.0 108.979 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -96.44 -33.52 11.85 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.173 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.513 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -146.06 151.52 37.86 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.119 -177.515 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -120.29 129.49 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.413 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.968 -178.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -60.96 142.22 56.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.971 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.416 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.3 tp -55.23 -40.58 71.03 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 124.734 1.214 . . . . 0.0 111.389 -177.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.598 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 36.0 t -54.14 -46.44 72.23 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.528 0.518 . . . . 0.0 109.808 178.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.1 t70 -74.9 -41.05 60.48 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.861 -176.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -60.53 -44.18 96.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.175 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 51.0 mtmt -65.37 -38.62 90.6 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.436 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.598 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 6.0 mptp? -61.63 -37.93 85.78 Favored 'General case' 0 C--O 1.243 0.75 0 O-C-N 123.012 0.195 . . . . 0.0 110.859 177.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 67.6 mm-40 -67.22 -50.39 60.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.14 -43.76 84.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.133 -176.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.9 mtm -63.97 -39.51 94.3 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 122.273 -0.267 . . . . 0.0 111.047 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -42.28 74.23 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.386 177.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.61 -46.46 75.79 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 52.2 mm-40 -92.07 2.34 56.63 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt 65.33 53.55 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 124.946 1.298 . . . . 0.0 111.051 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 8.7 mp -88.81 158.26 18.2 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.203 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -93.91 100.78 12.88 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-O 122.153 0.978 . . . . 0.0 109.172 175.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.31 60.33 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.991 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.42 -12.25 32.69 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.043 0.449 . . . . 0.0 111.447 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -105.45 -39.76 6.03 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.203 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.11 177.14 7.52 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.733 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -127.51 171.17 11.84 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.411 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 18.2 tp -118.41 125.46 50.02 Favored 'General case' 0 C--N 1.275 -2.667 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.498 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.8 tt0 -114.02 121.94 45.39 Favored 'General case' 0 C--N 1.29 -2.0 0 O-C-N 121.831 -0.543 . . . . 0.0 110.216 -175.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.0 mp -114.08 127.64 71.4 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.977 0 CA-C-O 120.969 0.414 . . . . 0.0 110.809 -175.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.9 m -111.21 144.61 40.09 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.487 ' HA ' HG11 ' A' ' 75' ' ' VAL . 11.0 t-20 -80.85 131.39 35.38 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.55 -11.07 58.7 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 120.963 0.411 . . . . 0.0 111.456 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -105.92 -47.92 3.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.006 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.6 p -89.68 -19.19 25.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt 71.85 14.55 5.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.456 1.502 . . . . 0.0 110.678 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -80.68 131.33 35.45 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -95.11 126.75 40.66 Favored 'General case' 0 N--CA 1.408 -2.53 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.491 ' CD1' ' HB2' ' A' ' 67' ' ' ALA . 32.6 m-85 -90.51 101.93 14.66 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -177.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.9 p -101.01 -22.22 14.81 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.161 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.03 147.61 26.74 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.504 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -76.32 -7.83 55.79 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.74 -10.91 58.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.491 ' HB2' ' CD1' ' A' ' 62' ' ' TYR . . . -62.2 141.46 58.18 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.12 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.513 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -117.53 138.42 51.91 Favored 'General case' 0 C--N 1.29 -2.018 0 O-C-N 121.908 -0.495 . . . . 0.0 111.437 -174.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.27 115.69 42.44 Favored Pre-proline 0 C--N 1.309 -1.162 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.441 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.476 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 54.7 Cg_endo -80.25 153.43 21.41 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.988 2.458 . . . . 0.0 113.592 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 16.1 ptmt -60.35 -20.27 58.79 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.852 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -75.31 -19.56 59.57 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.164 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.415 ' OG ' ' HG2' ' A' ' 70' ' ' PRO . 24.7 m -104.32 139.39 39.37 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-O 121.588 0.709 . . . . 0.0 112.455 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.3 m -97.89 129.38 44.83 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 171.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -123.95 164.39 22.11 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.5 mt -120.93 130.15 74.95 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.1 t -102.27 124.39 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.772 -173.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -120.33 145.03 47.52 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.0 ttm105 -100.68 125.85 47.15 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.498 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -129.49 156.29 78.83 Favored Pre-proline 0 C--O 1.217 -0.639 0 C-N-CA 121.249 -0.18 . . . . 0.0 110.83 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo . . . . . 0 CA--C 1.537 0.626 0 C-N-CA 122.079 1.852 . . . . 0.0 110.318 175.537 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.562 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.6 m . . . . . 0 N--CA 1.407 -2.591 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.5 p -148.43 143.33 26.7 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.834 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.434 HG22 ' CE1' ' A' ' 24' ' ' PHE . 98.6 t -106.26 131.94 54.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -77.56 112.32 14.22 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 124.056 0.848 . . . . 0.0 108.749 174.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.625 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -132.31 141.47 48.98 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -120.54 142.46 49.31 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 117.77 -1.572 . . . . 0.0 108.473 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.535 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -84.5 157.38 21.32 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 176.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -55.58 -31.0 61.82 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.254 0.622 . . . . 0.0 112.601 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -122.43 16.63 10.51 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.123 0.487 . . . . 0.0 111.106 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.535 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 16.1 tptm -86.13 -29.03 23.61 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.6 tp 74.04 -52.78 0.69 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.102 1.761 . . . . 0.0 112.174 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -98.75 152.61 19.49 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.081 -178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -74.95 142.86 43.9 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.915 0.864 . . . . 0.0 112.274 -178.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -115.24 178.74 4.18 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -140.4 117.36 11.11 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 120.866 0.365 . . . . 0.0 110.289 -174.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.564 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 13.0 p -95.37 118.7 42.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.4 p -85.66 127.33 34.46 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.974 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' A' ' 7' ' ' SER . 32.9 p90 -142.35 176.29 9.11 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -114.68 144.67 43.06 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.26 -179.14 19.8 Favored Glycine 0 C--N 1.306 -1.137 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -175.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -87.22 -33.36 19.35 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 118.03 0.915 . . . . 0.0 109.068 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.516 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -138.1 159.88 40.87 Favored 'General case' 0 CA--C 1.484 -1.576 0 CA-C-N 114.746 -1.116 . . . . 0.0 112.119 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.2 tt -128.28 128.53 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.098 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.536 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.6 m -62.66 147.03 50.65 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.256 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.73 -42.19 88.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 123.972 0.909 . . . . 0.0 112.697 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.581 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 33.7 t -56.5 -45.55 80.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.46 -45.78 82.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.909 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.36 -46.57 82.85 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.912 -176.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' HD21 ' A' ' 51' ' ' LEU . 52.8 mtmt -64.17 -41.18 97.24 Favored 'General case' 0 C--O 1.207 -1.139 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.581 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -62.94 -37.24 86.25 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -62.59 -50.62 70.54 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.025 0.441 . . . . 0.0 109.831 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.77 -47.8 68.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.87 -176.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.6 mtm -65.8 -33.59 76.21 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.43 35.71 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 119.211 -1.471 . . . . 0.0 111.16 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -59.63 -50.86 72.22 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.521 0.728 . . . . 0.0 111.931 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 7.7 mm-40 -92.72 0.22 57.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.266 0.555 . . . . 0.0 110.338 -174.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 60.75 70.93 0.59 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.69 1.196 . . . . 0.0 112.686 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.464 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.3 mp -103.97 144.2 31.84 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.526 -1.216 . . . . 0.0 108.899 175.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -92.9 103.49 15.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.972 0.892 . . . . 0.0 111.331 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.95 -16.48 62.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.43 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.04 1.75 51.88 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.308 0.575 . . . . 0.0 110.994 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -122.16 -36.72 2.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.608 0.718 . . . . 0.0 109.955 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -135.44 153.61 51.72 Favored 'General case' 0 N--CA 1.42 -1.951 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.717 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -108.6 159.92 16.34 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.44 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.6 tp -107.68 107.95 18.98 Favored 'General case' 0 C--N 1.267 -2.989 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.443 ' HB2' HG12 ' A' ' 80' ' ' ILE . 31.8 tt0 -103.43 108.96 20.42 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.908 0.861 . . . . 0.0 109.123 -173.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.427 HD11 HG21 ' A' ' 77' ' ' VAL . 25.3 mm -94.56 135.42 28.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.314 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.3 m -118.8 149.33 41.69 Favored 'General case' 0 C--N 1.281 -2.4 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.7 t-20 -72.49 139.69 47.79 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.45 -26.25 51.3 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.144 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -92.74 -58.15 2.44 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.449 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.9 p -87.94 -16.61 33.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.152 0.501 . . . . 0.0 110.67 -171.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 63.71 21.79 12.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.091 0.956 . . . . 0.0 111.489 -177.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -75.46 130.4 38.86 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.44 137.49 32.29 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-O 121.097 0.475 . . . . 0.0 110.665 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -103.77 103.0 12.84 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -106.39 -19.96 13.53 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.922 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -90.21 133.62 34.8 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.425 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.5 m-20 -66.96 -13.25 61.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 120.801 0.334 . . . . 0.0 111.881 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -85.43 -6.19 59.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.32 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.28 141.77 58.64 Favored 'General case' 0 C--O 1.208 -1.117 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.516 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.96 137.63 52.71 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -177.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.72 115.45 35.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.278 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -77.71 155.85 31.28 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.042 2.495 . . . . 0.0 113.254 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 53.5 pttt -69.71 -8.14 45.3 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.536 0.684 . . . . 0.0 111.447 178.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -81.56 -17.7 47.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.383 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.5 m -105.71 158.72 16.52 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.879 -177.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 m -119.62 136.86 54.21 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.625 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -130.9 166.24 29.09 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 CA-C-O 121.078 0.466 . . . . 0.0 111.102 -175.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.5 mt -120.03 130.57 74.11 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.427 HG21 HD11 ' A' ' 53' ' ' ILE . 57.6 t -102.01 122.47 54.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.005 -173.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -127.51 128.13 45.16 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 47.6 ttp180 -88.1 125.85 34.8 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.443 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -122.68 142.18 36.98 Favored Pre-proline 0 N--CA 1.439 -0.988 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 C--N 1.31 -1.481 0 C-N-CA 122.261 1.974 . . . . 0.0 110.847 178.154 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.8 m . . . . . 0 N--CA 1.403 -2.795 0 CA-C-O 120.983 0.42 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 14.5 p -146.37 140.19 26.18 Favored 'General case' 0 N--CA 1.418 -2.043 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.513 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.9 t -107.74 124.66 63.98 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.256 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -73.62 105.35 4.91 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 124.203 0.939 . . . . 0.0 108.893 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.627 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -124.97 133.39 53.03 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -108.31 134.73 50.73 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 117.205 -1.798 . . . . 0.0 108.283 174.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.407 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 1.2 t80 -97.88 161.79 13.56 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.161 -2.162 . . . . 0.0 105.161 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 t -59.71 -26.29 65.5 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 t -87.86 -12.0 46.12 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.175 0.512 . . . . 0.0 110.833 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 2.8 mptp? -96.18 133.09 40.91 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 177.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.68 -22.76 25.89 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.3 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 18.7 m120 -120.42 168.62 11.12 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.572 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -76.5 144.67 39.64 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.644 0.735 . . . . 0.0 112.122 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -104.85 177.88 4.72 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.2 p -141.77 113.68 7.96 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 118.716 0.689 . . . . 0.0 112.006 -174.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.16 136.61 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.9 p -108.24 145.47 34.26 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -174.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.1 p90 -158.71 157.36 31.63 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.12 115.35 28.84 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 118.224 0.465 . . . . 0.0 109.78 175.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.23 175.6 14.97 Favored Glycine 0 C--N 1.284 -2.345 0 N-CA-C 108.205 -1.958 . . . . 0.0 108.205 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.0 tp -85.43 -32.86 22.1 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 118.409 1.105 . . . . 0.0 110.774 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.428 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -145.5 151.24 37.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -177.247 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.9 131.37 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.039 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.622 -177.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.1 m -61.84 148.05 44.55 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 123.122 0.569 . . . . 0.0 110.376 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 124.059 0.944 . . . . 0.0 111.394 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.618 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 49.5 t -55.59 -46.13 77.32 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -69.71 -44.33 70.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.261 0.553 . . . . 0.0 110.289 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.43 -45.82 89.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.09 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.527 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.0 mtmt -62.7 -42.96 99.91 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.922 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.618 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.3 mptp? -61.47 -35.44 77.64 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 120.753 0.311 . . . . 0.0 111.123 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -69.85 -42.71 73.19 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.457 ' O ' ' HB3' ' A' ' 41' ' ' ARG . 66.3 mt -74.34 -36.21 41.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.691 0.281 . . . . 0.0 111.444 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.5 mtt -62.45 -46.0 90.49 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.83 -38.67 93.16 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.258 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 25.8 tpt180 -54.62 -50.24 68.57 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.552 1.541 . . . . 0.0 110.925 178.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.41 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 67.1 mm-40 -100.58 6.29 44.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -176.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.415 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 63.96 36.23 10.21 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.591 0.756 . . . . 0.0 111.999 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.41 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.3 mp -66.74 154.05 41.72 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.599 0.714 . . . . 0.0 112.382 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.436 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 19.9 ptmt -98.44 106.88 19.22 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.652 173.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.83 -6.06 55.06 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.231 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.96 -5.5 59.23 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.904 177.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.436 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 17.9 t70 -128.88 -42.36 1.41 Allowed 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.511 0.672 . . . . 0.0 109.756 176.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.5 m -120.62 157.58 29.23 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -113.46 169.34 9.03 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.7 tp -119.62 113.41 20.65 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 119.756 -0.778 . . . . 0.0 108.953 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HB2' HG12 ' A' ' 80' ' ' ILE . 9.3 tt0 -106.53 120.5 42.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.049 -177.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.1 mm -106.5 135.68 43.96 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.7 -171.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 23.4 m -117.28 151.06 37.73 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 175.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -78.03 145.71 35.75 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 175.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.29 -21.86 24.2 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.304 0.573 . . . . 0.0 110.861 -178.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -96.75 -48.87 5.31 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.579 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 35.9 p -93.77 -21.89 19.03 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.02 0.438 . . . . 0.0 110.353 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 68.3 19.36 9.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.037 1.335 . . . . 0.0 112.139 -175.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.51 125.8 27.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.9 mt-10 -87.73 127.48 35.31 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.224 0.535 . . . . 0.0 110.785 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -93.04 100.95 13.28 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.0 p -99.19 -35.86 9.85 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.646 -176.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -85.88 135.71 33.59 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -66.8 -12.45 58.96 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -90.91 -1.42 57.84 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.867 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.92 148.29 51.77 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.428 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.62 137.63 53.14 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 118.393 0.542 . . . . 0.0 110.689 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -115.87 118.45 38.58 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.968 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.431 ' C ' ' H ' ' A' ' 72' ' ' ASN . 83.3 Cg_endo -83.62 157.5 14.18 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.097 2.532 . . . . 0.0 112.982 176.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.74 3.26 5.3 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 122.495 1.141 . . . . 0.0 110.78 176.462 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 70' ' ' PRO . 15.2 m120 -87.68 -18.55 29.28 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.05 176.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.7 m -116.31 151.59 35.56 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.355 0.598 . . . . 0.0 111.74 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.2 t -105.96 137.63 43.53 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 176.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -128.46 159.65 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-O 121.648 0.737 . . . . 0.0 112.781 -177.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.3 mm -109.42 126.29 66.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.4 123.26 54.38 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.283 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 ttp-105 -122.94 124.48 43.29 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.225 0.536 . . . . 0.0 109.856 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -83.59 120.33 25.83 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.495 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -124.66 153.84 70.06 Favored Pre-proline 0 C--O 1.201 -1.471 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -178.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 CA--C 1.538 0.699 0 C-N-CA 122.07 1.847 . . . . 0.0 111.947 179.592 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.464 ' O ' ' HA ' ' A' ' 23' ' ' THR . 70.8 m . . . . . 0 N--CA 1.397 -3.099 0 CA-C-O 121.673 0.749 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.2 p -140.38 132.79 28.45 Favored 'General case' 0 N--CA 1.399 -3.023 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.04 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 21' ' ' THR . 43.5 t -107.11 127.96 62.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.534 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 62.7 m-70 -79.66 105.64 11.1 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 174.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.2 p90 -118.0 142.3 47.52 Favored 'General case' 0 C--N 1.28 -2.426 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -123.65 124.27 42.39 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 118.77 -1.172 . . . . 0.0 110.199 174.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.438 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -80.32 157.89 26.26 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 177.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 m -56.89 -37.68 71.72 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.042 0.448 . . . . 0.0 110.229 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 p -88.06 -8.59 55.32 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.43 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 31.5 tptt -83.37 -37.73 22.93 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 tt 73.65 -51.78 0.7 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 125.726 1.61 . . . . 0.0 109.571 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -100.18 170.01 8.75 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -88.2 155.66 19.64 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.22 0.533 . . . . 0.0 111.095 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.534 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.6 t70 -128.33 178.53 6.2 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -133.78 117.88 17.4 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 119.366 0.984 . . . . 0.0 112.258 -173.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.581 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.4 p -99.9 123.14 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.7 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 7' ' ' SER . 36.1 p -92.03 143.06 26.85 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.968 -177.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -154.6 172.23 18.18 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.681 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.59 133.0 43.56 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.229 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.85 178.59 21.58 Favored Glycine 0 C--N 1.292 -1.915 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.03 -33.96 19.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.427 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -137.78 164.1 29.74 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.011 -179.15 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.0 tt -134.1 131.08 55.44 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.548 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m -63.58 143.16 58.06 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.9 tp -54.54 -40.08 68.32 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.27 1.428 . . . . 0.0 113.351 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.527 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.5 t -55.96 -45.89 78.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.719 0.295 . . . . 0.0 110.539 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.88 -41.73 70.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.26 -46.13 85.05 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.978 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.7 mtmt -61.73 -42.56 99.12 Favored 'General case' 0 C--O 1.206 -1.199 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.45 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.527 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.75 -35.11 77.15 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.27 0.356 . . . . 0.0 111.849 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -70.64 -45.68 64.72 Favored 'General case' 0 C--O 1.21 -1.009 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.109 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.4 -38.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.846 0.355 . . . . 0.0 111.348 -178.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.5 mtt -63.7 -38.99 93.2 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.6 -31.8 60.24 Favored Glycine 0 C--O 1.219 -0.833 0 N-CA-C 111.771 -0.531 . . . . 0.0 111.771 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.488 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 24.9 tpt180 -64.59 -51.36 63.15 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 124.818 1.247 . . . . 0.0 110.865 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -94.63 -17.95 21.82 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 80.4 70.14 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 125.811 1.645 . . . . 0.0 111.825 -176.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -97.55 165.93 11.75 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 114.803 -1.089 . . . . 0.0 111.793 176.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -107.19 101.79 11.16 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.235 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.77 -13.98 60.66 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.925 -173.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.52 2.38 56.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.721 0.772 . . . . 0.0 110.374 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -119.21 -36.26 3.42 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.742 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.3 p -139.22 162.48 34.89 Favored 'General case' 0 C--N 1.297 -1.695 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.806 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -114.6 166.58 11.58 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 tp -117.33 105.54 12.28 Favored 'General case' 0 C--N 1.263 -3.153 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -90.93 123.42 34.41 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.8 mm -110.84 135.22 50.62 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.571 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.0 m -123.19 140.73 52.72 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.558 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.9 t-20 -71.52 139.68 49.62 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -29.66 55.88 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.631 0.729 . . . . 0.0 110.687 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -94.32 -49.64 5.62 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.127 -173.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.4 p -93.18 -18.23 22.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.291 0.567 . . . . 0.0 109.475 -175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 42.0 mmtm 65.15 22.55 12.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.603 1.161 . . . . 0.0 112.242 -177.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -78.06 129.26 35.02 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -83.73 136.89 34.0 Favored 'General case' 0 N--CA 1.412 -2.373 0 CA-C-O 121.336 0.588 . . . . 0.0 109.595 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -96.13 98.73 10.57 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 3.2 p -91.8 -40.98 10.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -175.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -91.87 147.45 22.96 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.448 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 13.5 m-20 -66.06 -16.03 63.58 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.887 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -88.96 -1.33 58.05 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.201 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.42 145.4 55.72 Favored 'General case' 0 C--O 1.209 -1.076 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.427 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.06 137.73 52.71 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 119.928 -0.709 . . . . 0.0 112.696 -172.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.13 117.97 40.75 Favored Pre-proline 0 C--N 1.312 -1.024 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.87 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.406 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 64.4 Cg_endo -81.83 154.48 17.58 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.083 2.522 . . . . 0.0 112.827 174.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.432 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.17 -10.72 56.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -87.76 -2.05 58.36 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.319 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 55.2 m -106.92 140.0 40.42 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.302 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 m -100.0 131.67 45.82 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 172.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 27.0 m -125.88 159.86 33.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -176.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 mm -105.07 135.34 43.5 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 45.5 t -111.73 117.66 55.67 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-O 120.973 0.416 . . . . 0.0 110.085 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -119.38 122.9 42.84 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.407 0.683 . . . . 0.0 109.993 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -77.97 121.6 24.41 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pp -121.37 146.72 45.55 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.867 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--N 1.313 -1.322 0 C-N-CA 122.344 2.029 . . . . 0.0 111.043 178.0 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.581 ' O ' ' HA ' ' A' ' 23' ' ' THR . 3.3 m . . . . . 0 N--CA 1.416 -2.142 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.3 p -138.11 134.17 34.31 Favored 'General case' 0 N--CA 1.419 -2.007 0 C-N-CA 119.542 -0.863 . . . . 0.0 111.855 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.437 HG22 ' CE1' ' A' ' 24' ' ' PHE . 74.5 t -106.67 125.59 62.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 175.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -77.82 119.75 21.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.646 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 43.1 p90 -133.98 138.55 45.51 Favored 'General case' 0 C--N 1.286 -2.176 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -118.46 146.12 44.73 Favored 'General case' 0 N--CA 1.426 -1.649 0 C-N-CA 118.433 -1.307 . . . . 0.0 107.678 173.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -92.87 169.4 10.49 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -63.7 -16.68 61.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.901 0.857 . . . . 0.0 110.708 174.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.0 m -138.15 107.85 6.25 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 171.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 12.4 tppt? -177.81 -39.23 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -176.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.0 tp 76.71 -52.53 0.58 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.905 1.682 . . . . 0.0 111.136 -178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -102.01 172.65 6.79 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -94.99 143.38 26.52 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-O 121.24 0.543 . . . . 0.0 109.672 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -104.6 177.76 4.75 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 175.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.13 116.29 9.44 Favored 'General case' 0 C--N 1.275 -2.642 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -173.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 15.0 p -95.16 116.94 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.782 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.581 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.2 p -89.42 124.36 34.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.587 0.708 . . . . 0.0 112.201 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.437 ' CE1' HG22 ' A' ' 9' ' ' VAL . 31.6 p90 -132.92 177.17 7.86 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -176.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -113.8 136.1 53.23 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.95 174.48 17.17 Favored Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -82.12 -35.58 28.38 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.484 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -135.08 159.24 42.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -179.753 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.4 tt -127.4 126.14 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.572 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.0 m -59.74 141.36 55.35 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.957 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.436 HD13 ' CG1' ' A' ' 53' ' ' ILE . 56.8 tp -55.24 -40.91 71.43 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 123.973 0.909 . . . . 0.0 112.045 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.727 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 9.3 t -56.3 -46.66 79.71 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.593 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.8 t70 -68.05 -43.92 77.57 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 -177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.22 -46.61 89.71 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.883 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HD2' ' O ' ' A' ' 51' ' ' LEU . 44.2 mtmt -67.13 -40.48 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.707 0.289 . . . . 0.0 110.645 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.727 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.3 mptt -65.03 -34.09 77.61 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.093 178.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 83.2 mm-40 -62.13 -49.95 73.84 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.353 0.596 . . . . 0.0 109.495 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.3 mt -67.76 -47.85 78.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.627 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.1 mtm -63.33 -37.24 86.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.853 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.43 61.89 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.154 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -72.39 -49.55 33.01 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 122.628 0.371 . . . . 0.0 111.548 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 44.2 mt-10 -93.45 -1.74 55.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 18.9 mmtp 71.75 45.02 0.45 Allowed 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.411 1.085 . . . . 0.0 111.225 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.7 mp -73.34 162.99 28.71 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.942 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HB3' ' HZ2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -92.46 100.28 12.86 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.133 178.565 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.07 -14.73 58.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.887 -173.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.68 -4.39 23.83 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.878 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -103.1 -42.55 5.74 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.972 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.4 m -133.65 166.17 23.24 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.7 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -108.13 162.14 14.33 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.491 HD12 ' CG1' ' A' ' 77' ' ' VAL . 33.1 tp -107.44 125.05 50.75 Favored 'General case' 0 C--N 1.251 -3.674 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.527 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.2 tt0 -110.67 128.93 55.91 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 -178.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.436 ' CG1' HD13 ' A' ' 31' ' ' LEU . 44.7 mm -113.31 133.62 58.62 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -176.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 m -116.71 153.39 32.46 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -83.86 146.51 28.05 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.08 -12.45 28.48 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.267 0.556 . . . . 0.0 111.187 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -103.76 -39.64 6.58 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.096 -176.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -100.04 -25.11 14.42 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.8 mmmm 68.84 24.93 6.33 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.099 1.359 . . . . 0.0 111.131 -176.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -90.24 135.51 33.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.731 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -78.81 141.53 37.67 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 121.043 0.449 . . . . 0.0 110.959 175.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -103.21 99.4 9.25 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 173.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 p -82.22 -31.18 30.42 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.402 ' O ' HD22 ' A' ' 31' ' ' LEU . 2.2 m-20 -105.87 139.42 40.46 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.513 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -63.19 -7.25 5.51 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.066 0.946 . . . . 0.0 111.454 178.179 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -90.63 -0.16 57.59 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.368 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.04 152.05 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.484 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.76 137.35 53.42 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 118.21 0.459 . . . . 0.0 110.36 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -116.34 117.3 38.75 Favored Pre-proline 0 C--N 1.304 -1.386 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.652 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.7 Cg_endo -79.77 159.7 24.72 Favored 'Trans proline' 0 C--N 1.323 -0.779 0 C-N-CA 122.936 2.424 . . . . 0.0 112.683 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.1 pttt -70.59 1.01 5.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.486 0.66 . . . . 0.0 111.327 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -87.81 -11.26 48.49 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.8 m -122.21 149.35 43.79 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 121.389 0.614 . . . . 0.0 112.56 -172.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 m -103.43 133.28 48.75 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.646 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 19.2 m -126.25 169.78 17.18 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 CA-C-O 120.924 0.392 . . . . 0.0 111.026 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mt -123.95 136.11 61.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 123.704 0.802 . . . . 0.0 109.012 -177.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.491 ' CG1' HD12 ' A' ' 51' ' ' LEU . 26.3 t -106.23 128.58 60.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.472 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -136.73 133.4 36.04 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -89.62 132.42 35.13 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -131.44 152.65 80.85 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 118.215 0.461 . . . . 0.0 110.318 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo . . . . . 0 C--O 1.242 0.72 0 C-N-CA 121.795 1.663 . . . . 0.0 110.875 177.184 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.511 ' O ' ' HA ' ' A' ' 23' ' ' THR . 41.9 m . . . . . 0 N--CA 1.415 -2.196 0 CA-C-O 120.78 0.324 . . . . 0.0 111.797 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.1 p -148.53 135.19 19.78 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.357 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.531 HG22 ' CE1' ' A' ' 24' ' ' PHE . 98.3 t -107.06 134.43 48.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -84.0 109.68 17.83 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -127.82 138.97 52.9 Favored 'General case' 0 C--N 1.277 -2.555 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -121.03 137.52 54.61 Favored 'General case' 0 C--N 1.281 -2.398 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -90.42 156.77 17.98 Favored 'General case' 0 C--N 1.283 -2.29 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.6 m -56.92 -29.19 62.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.899 0.381 . . . . 0.0 111.007 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.6 m -83.76 -10.96 57.74 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.311 0.644 . . . . 0.0 111.813 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -101.19 156.98 17.11 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 122.107 -0.37 . . . . 0.0 110.873 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.9 mt -97.56 -43.24 7.31 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.736 0.779 . . . . 0.0 108.949 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -114.54 167.64 10.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.394 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -76.12 149.1 37.44 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.948 0.88 . . . . 0.0 112.779 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -112.16 177.11 4.75 Favored 'General case' 0 C--N 1.28 -2.441 0 N-CA-C 105.126 -2.175 . . . . 0.0 105.126 174.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.442 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -140.18 113.53 8.49 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 118.612 0.642 . . . . 0.0 110.354 -174.035 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 12.2 p -96.3 124.07 48.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.402 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 7' ' ' SER . 13.3 p -87.3 140.07 29.92 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.648 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.531 ' CE1' HG22 ' A' ' 9' ' ' VAL . 33.0 p90 -148.08 167.36 25.18 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 120.987 0.423 . . . . 0.0 110.736 -178.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -101.63 116.15 32.1 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.611 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.42 177.07 15.46 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 110.435 -1.066 . . . . 0.0 110.435 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.3 tp -77.52 -30.98 53.14 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 122.021 0.915 . . . . 0.0 109.529 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.568 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.76 158.72 43.46 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.533 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 tt -124.53 128.1 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.103 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 m -62.1 142.3 57.65 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.944 175.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 58.2 tp -54.41 -39.87 67.71 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 125.301 1.441 . . . . 0.0 112.262 -176.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.55 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -55.83 -46.19 78.18 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 123.24 0.337 . . . . 0.0 110.602 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.1 t70 -73.34 -39.08 65.49 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -175.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.76 -46.19 89.19 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.05 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 53.4 mtmt -66.32 -39.76 89.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.0 mptp? -61.71 -40.35 94.72 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.275 178.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 64.6 mt-30 -66.9 -50.32 62.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.445 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.72 -43.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.631 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.482 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 71.1 mtm -64.27 -45.07 89.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.74 -178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.38 -33.89 61.09 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.965 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -75.09 -46.75 32.56 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 32.2 mm-40 -94.24 13.13 24.36 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp 68.16 34.04 4.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.518 1.127 . . . . 0.0 111.873 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 10.5 mp -74.62 174.19 9.39 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.172 0.987 . . . . 0.0 112.819 -178.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.524 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 13.2 ptpt -109.82 108.28 18.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.618 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.37 -20.71 31.52 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -175.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -107.04 -15.13 14.76 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.947 0.403 . . . . 0.0 111.343 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.524 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 14.4 t70 -92.56 -27.66 17.23 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -176.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -147.94 167.51 24.66 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -110.87 169.5 8.72 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.2 tp -127.52 119.78 26.8 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.492 ' HB2' HG12 ' A' ' 80' ' ' ILE . 39.4 tt0 -121.63 136.98 54.92 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -115.39 135.62 54.79 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.904 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -176.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 m -121.51 146.03 47.35 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.489 ' HA ' HG11 ' A' ' 75' ' ' VAL . 13.8 t-20 -74.64 137.22 42.1 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.77 43.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.364 0.602 . . . . 0.0 111.205 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -100.06 -52.84 3.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.929 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.3 p -92.23 -16.59 25.97 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.6 mmmm 68.41 17.13 9.19 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.749 1.219 . . . . 0.0 111.463 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -81.4 132.42 35.32 Favored 'General case' 0 N--CA 1.433 -1.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -83.85 146.71 27.95 Favored 'General case' 0 N--CA 1.415 -2.195 0 CA-C-O 121.577 0.703 . . . . 0.0 110.416 178.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -107.22 103.83 13.3 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -100.38 -36.99 9.04 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -88.61 140.01 29.89 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 2.0 m-20 -68.61 -10.79 58.17 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -88.83 -4.45 58.49 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.035 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 142.89 58.24 Favored 'General case' 0 C--O 1.208 -1.095 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.568 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -117.14 137.79 52.08 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.586 -173.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.62 117.87 37.54 Favored Pre-proline 0 C--N 1.306 -1.323 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 91.2 Cg_endo -81.3 160.22 20.09 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 123.233 2.622 . . . . 0.0 114.063 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -67.96 -9.19 43.37 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.889 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -87.91 -1.57 58.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.423 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.9 m -121.01 157.34 30.2 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 121.406 0.622 . . . . 0.0 112.233 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 m -115.06 130.83 57.03 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 174.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 55' ' ' ASN . 29.4 m -127.26 160.22 36.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.46 0.647 . . . . 0.0 112.694 -175.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.4 mm -104.0 123.86 58.01 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.6 t -104.43 120.12 54.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -127.13 130.51 49.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.239 -172.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -83.52 120.93 26.54 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.492 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -117.59 156.62 49.22 Favored Pre-proline 0 C--N 1.313 -0.985 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.735 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 26.0 Cg_endo . . . . . 0 N--CA 1.453 -0.86 0 C-N-CA 122.231 1.954 . . . . 0.0 112.798 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.518 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 50.3 m . . . . . 0 N--CA 1.422 -1.845 0 CA-C-O 121.28 0.562 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.0 p -132.95 135.72 45.69 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.85 -177.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.8 t -110.29 126.61 67.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -82.4 111.34 18.36 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.621 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.2 p90 -127.36 139.91 52.54 Favored 'General case' 0 C--N 1.28 -2.44 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -123.1 139.28 54.24 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.001 -1.48 . . . . 0.0 107.876 174.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -78.7 171.23 15.45 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -57.77 -37.54 73.85 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 123.28 0.632 . . . . 0.0 111.867 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.7 m -102.22 9.78 39.79 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-O 121.067 0.46 . . . . 0.0 111.918 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -92.71 135.19 34.32 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.2 mt -96.79 -24.12 16.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.428 0.632 . . . . 0.0 109.796 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -107.13 165.18 11.55 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -92.63 138.59 31.37 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.289 0.566 . . . . 0.0 110.219 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 173.24 7.79 Favored 'General case' 0 C--N 1.281 -2.37 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 175.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.51 128.95 30.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -111.86 138.89 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.222 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 176.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -116.7 143.84 45.15 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.1 p90 -153.7 176.81 11.68 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -125.81 130.56 51.65 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.403 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.34 -114.63 1.19 Allowed Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -140.9 -45.75 0.39 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.571 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -141.5 158.45 43.83 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -177.36 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -125.43 129.78 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.289 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -63.86 149.52 46.85 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 122.881 0.472 . . . . 0.0 110.471 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 tp -57.61 -44.75 85.7 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -174.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.531 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 50.4 t -56.64 -45.51 81.53 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.953 177.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.96 -42.31 94.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.416 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -62.67 -47.47 83.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.267 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' HD21 ' A' ' 51' ' ' LEU . 52.6 mtmt -67.21 -41.82 85.13 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.275 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.531 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -61.7 -35.18 77.3 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -69.1 -49.15 59.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 0.0 110.546 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.2 mt -69.56 -44.09 79.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.311 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.94 -37.34 86.66 Favored 'General case' 0 CA--C 1.51 -0.591 0 O-C-N 122.23 -0.294 . . . . 0.0 111.34 -178.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.94 -41.58 87.52 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -66.89 -38.07 85.59 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 123.079 0.551 . . . . 0.0 112.119 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.96 11.87 37.83 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.967 0.413 . . . . 0.0 111.158 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? 59.34 38.36 23.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.513 172.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.13 152.91 40.98 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -83.85 100.48 10.99 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.36 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.41 -8.3 59.41 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.195 -173.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 6.69 42.59 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.155 0.503 . . . . 0.0 109.993 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -130.23 -40.84 1.28 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.403 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.78 172.54 9.23 Favored 'General case' 0 N--CA 1.418 -2.059 0 CA-C-O 121.552 0.691 . . . . 0.0 111.241 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -126.3 166.74 16.57 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.437 HD21 ' HA ' ' A' ' 35' ' ' LYS . 19.9 tp -111.32 118.29 35.48 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.456 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.4 tp60 -104.51 126.13 51.31 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -108.92 135.23 48.44 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.7 m -127.17 136.68 52.41 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.473 ' HA ' HG13 ' A' ' 75' ' ' VAL . 12.3 t-20 -64.97 135.09 55.25 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 117.892 0.314 . . . . 0.0 110.3 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.9 -23.26 58.34 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.228 0.537 . . . . 0.0 110.786 -178.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -94.98 -55.81 2.96 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.874 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -92.72 -15.78 26.26 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.891 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.95 21.23 12.54 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.537 0.735 . . . . 0.0 112.458 -174.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -71.96 117.86 14.1 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -81.52 138.91 35.4 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.07 96.98 7.59 Favored 'General case' 0 C--N 1.274 -2.712 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.2 p -94.59 -20.02 19.98 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.742 -175.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.64 129.46 45.78 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.574 -174.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -71.22 -7.59 47.86 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.709 0.686 . . . . 0.0 112.191 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -93.07 2.15 56.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.27 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.31 147.64 49.41 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 175.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.571 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.54 138.35 51.96 Favored 'General case' 0 C--N 1.28 -2.428 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.685 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -113.96 114.33 46.47 Favored Pre-proline 0 C--N 1.307 -1.279 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.858 175.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.464 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.3 Cg_endo -77.75 161.28 30.68 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.097 2.532 . . . . 0.0 112.806 175.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 19.9 pttm -66.92 -8.86 32.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.789 0.804 . . . . 0.0 111.219 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.61 -3.22 58.98 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.497 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.2 m -114.72 125.48 53.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 120.903 0.382 . . . . 0.0 111.404 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.0 m -90.26 123.58 34.16 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.621 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 23.6 m -123.54 155.12 29.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.431 0.634 . . . . 0.0 112.598 -175.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.26 132.23 48.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.409 ' CG1' HD12 ' A' ' 51' ' ' LEU . 70.5 t -105.93 125.46 61.43 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.577 -176.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -131.42 145.24 51.71 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 ttp85 -99.96 126.29 46.1 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 122.051 -0.406 . . . . 0.0 109.987 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.456 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.66 155.61 66.0 Favored Pre-proline 0 C--N 1.314 -0.976 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -178.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 CA--C 1.545 1.05 0 C-N-CA 122.316 2.01 . . . . 0.0 111.94 177.064 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 N--CA 1.409 -2.482 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 18.3 p -124.07 135.42 53.55 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.437 -175.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 21' ' ' THR . 54.0 t -107.93 124.77 64.34 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.418 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 80.2 m-70 -78.04 110.59 13.12 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.518 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.514 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 31.0 p90 -128.47 141.37 51.41 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -177.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.408 ' HE3' HD11 ' A' ' 76' ' ' ILE . 18.6 pttp -117.11 130.94 56.97 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.341 -1.344 . . . . 0.0 107.894 172.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.404 ' CZ ' HD22 ' A' ' 44' ' ' LEU . 1.9 t80 -85.03 163.44 18.85 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.516 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 11.5 m -56.9 -24.99 56.09 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 123.398 0.679 . . . . 0.0 111.515 175.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.5 m -94.9 -8.58 36.72 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.537 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -112.22 124.46 52.5 Favored 'General case' 0 CA--C 1.506 -0.728 0 O-C-N 121.869 -0.519 . . . . 0.0 110.348 -176.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mp -88.92 -4.87 58.33 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.509 0.671 . . . . 0.0 110.43 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -122.22 167.43 13.22 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -91.02 143.7 26.43 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.591 0.71 . . . . 0.0 112.321 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.6 t70 -111.83 177.88 4.5 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -140.21 117.45 11.29 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 118.21 0.459 . . . . 0.0 110.951 -174.435 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.6 142.07 14.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.8 p -116.29 133.26 56.21 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -174.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 28.2 p90 -143.12 177.03 8.67 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.602 1.161 . . . . 0.0 107.927 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -120.62 128.35 52.94 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.01 -114.03 1.04 Allowed Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.509 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -145.02 -42.45 0.23 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.508 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.08 153.36 42.1 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.4 tt -121.53 132.42 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.852 -178.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.428 ' HB2' ' OD1' ' A' ' 33' ' ' ASP . 37.5 m -64.75 146.52 54.68 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.03 176.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.58 -43.34 84.51 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 124.528 1.131 . . . . 0.0 113.257 -174.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.593 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 37.4 t -56.88 -45.83 82.26 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 30' ' ' SER . 9.0 m-20 -63.38 -47.46 81.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.663 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.56 -47.47 84.13 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.521 1.128 . . . . 0.0 110.708 -176.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.404 ' HA ' HD21 ' A' ' 51' ' ' LEU . 53.7 mtmt -69.35 -43.48 73.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.952 -178.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.9 mptp? -61.85 -39.38 91.65 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 90.8 mt-30 -64.99 -50.57 65.81 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.7 mt -63.91 -47.54 90.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.884 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.95 -33.61 76.45 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.268 -178.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.66 -43.23 36.88 Favored Glycine 0 C--N 1.312 -0.797 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.268 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -59.52 -42.46 92.29 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 125.093 1.357 . . . . 0.0 111.838 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 33.6 mt-10 -104.05 8.92 36.63 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.043 -175.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.72 64.23 1.35 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.277 175.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.445 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -99.73 -176.36 3.24 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.896 177.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -107.47 100.62 10.03 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.88 0.848 . . . . 0.0 110.423 174.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.56 -18.33 38.7 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.719 -176.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.63 9.21 35.73 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.908 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -133.36 -47.2 0.83 Allowed 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.762 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.9 m -112.63 176.95 4.8 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.892 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 80' ' ' ILE . 37.2 t70 -124.09 163.08 22.21 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.3 tp -118.5 108.96 15.64 Favored 'General case' 0 N--CA 1.397 -3.104 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.559 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.3 tp-100 -91.39 120.81 32.57 Favored 'General case' 0 C--N 1.284 -2.255 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.408 ' CD1' HG11 ' A' ' 77' ' ' VAL . 35.2 mm -110.8 127.87 67.58 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.038 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -174.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 m -122.32 140.02 53.14 Favored 'General case' 0 C--N 1.268 -2.946 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.438 ' HA ' HG13 ' A' ' 75' ' ' VAL . 11.5 t-20 -65.37 131.83 47.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.87 -30.77 70.22 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.284 0.564 . . . . 0.0 110.746 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -91.48 -58.28 2.49 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.161 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.7 p -85.66 -14.94 43.99 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.038 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 44.4 mmtm 65.25 20.54 11.92 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.045 0.938 . . . . 0.0 111.685 -177.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.82 119.75 14.52 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.957 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -85.39 138.25 32.4 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-O 121.309 0.576 . . . . 0.0 109.92 177.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -100.61 90.42 4.26 Favored 'General case' 0 C--N 1.278 -2.504 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -82.48 -39.61 22.24 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.073 -175.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.699 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 6.8 m-20 -85.53 138.73 32.0 Favored 'General case' 0 CA--C 1.482 -1.638 0 CA-C-N 116.717 -0.219 . . . . 0.0 110.873 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -66.57 -12.37 57.5 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.267 0.556 . . . . 0.0 111.239 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.699 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 8.7 p30 -92.87 1.01 57.51 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.43 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.86 151.64 46.32 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.508 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -118.71 138.02 52.93 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 118.137 0.426 . . . . 0.0 111.384 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.92 115.93 43.11 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.927 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.44 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 48.6 Cg_endo -75.67 153.61 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.867 2.378 . . . . 0.0 113.472 175.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -63.67 -18.22 63.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.561 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -85.53 -4.93 59.31 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.655 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 43.5 m -116.88 139.29 50.8 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 120.906 0.384 . . . . 0.0 111.188 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 t -96.53 135.67 38.1 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -128.82 157.0 41.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 CA-C-O 121.251 0.548 . . . . 0.0 111.693 -177.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.408 HD11 ' HE3' ' A' ' 12' ' ' LYS . 31.3 mm -102.04 132.69 47.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.412 HG22 ' HB2' ' A' ' 11' ' ' TYR . 54.4 t -110.33 107.23 22.38 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.144 0 CA-C-O 121.442 0.639 . . . . 0.0 110.145 -175.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.516 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 12.0 tpt180 -110.34 123.7 50.33 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.199 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -81.66 122.62 27.86 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 176.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -125.81 156.59 71.04 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 120.477 0.179 . . . . 0.0 110.779 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo . . . . . 0 CA--C 1.546 1.103 0 C-N-CA 122.378 2.052 . . . . 0.0 111.11 175.818 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.606 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.1 m . . . . . 0 N--CA 1.428 -1.572 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.9 p -137.93 140.45 40.3 Favored 'General case' 0 N--CA 1.419 -2.0 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.694 -176.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.404 HG21 ' CE1' ' A' ' 24' ' ' PHE . 77.3 t -106.78 124.69 62.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -79.78 114.61 18.84 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 175.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.0 p90 -130.36 141.16 50.58 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -130.56 136.83 49.3 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.57 173.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -86.08 165.67 16.45 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -175.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -58.51 -31.61 68.06 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.845 0.831 . . . . 0.0 108.957 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 m -84.32 -13.65 51.83 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 114.9 -1.045 . . . . 0.0 112.049 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HD2' ' OE1' ' A' ' 42' ' ' GLU . 54.6 mtpt -116.08 126.46 53.78 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 121.885 -0.509 . . . . 0.0 111.252 -173.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.45 -41.01 48.93 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.086 -0.507 . . . . 0.0 112.063 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -104.86 159.56 15.7 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.031 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -77.29 136.96 38.53 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 121.341 0.591 . . . . 0.0 111.982 -177.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -100.24 172.83 6.92 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 p -138.29 122.53 18.14 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -94.37 113.63 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 7' ' ' SER . 6.1 p -88.14 111.18 21.31 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.301 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.606 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.9 p90 -128.17 154.8 45.39 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -96.23 101.58 13.25 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.681 0.753 . . . . 0.0 109.675 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 157.49 -174.32 34.94 Favored Glycine 0 C--N 1.287 -2.162 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.64 -42.53 7.21 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.19 150.74 47.05 Favored 'General case' 0 CA--C 1.484 -1.596 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.75 179.788 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -120.65 129.39 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.4 0 CA-C-N 115.025 -0.988 . . . . 0.0 111.299 -177.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.8 m -56.83 141.62 43.91 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.609 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.448 HD21 ' O ' ' A' ' 64' ' ' ASP . 57.7 tp -56.12 -41.87 75.97 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -176.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.554 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 43.4 t -58.34 -45.93 87.22 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 2.9 m-20 -66.49 -44.52 82.38 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.534 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -59.12 -46.35 88.57 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 124.302 1.041 . . . . 0.0 110.016 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.52 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.3 mtmt -64.18 -42.27 96.75 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.655 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.554 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.47 -38.63 87.94 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 12.6 mm100 -62.11 -47.97 82.26 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.317 0.579 . . . . 0.0 109.56 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.8 mt -68.72 -42.78 83.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.325 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.52 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.3 mtt -61.39 -40.82 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.22 0.208 . . . . 0.0 111.065 -178.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.25 -35.78 60.24 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.544 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.457 ' HD2' ' OH ' ' A' ' 11' ' ' TYR . 31.5 ttm180 -73.12 -44.55 60.07 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.833 0.349 . . . . 0.0 111.864 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.478 ' OE1' ' HD2' ' A' ' 16' ' ' LYS . 58.6 mm-40 -91.56 9.05 33.71 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.601 -176.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . 0.34 0.0 OUTLIER 45.55 66.52 0.9 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.004 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -93.81 145.27 24.72 Favored 'General case' 0 CA--C 1.491 -1.306 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.596 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.432 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 8.0 ptpp? -88.87 101.56 14.17 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.186 173.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.26 -13.79 59.87 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.019 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.21 8.56 23.45 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.62 0.724 . . . . 0.0 109.985 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.432 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 15.0 t70 -130.57 -45.19 1.08 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.563 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.558 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 13.3 p -132.72 167.86 19.37 Favored 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.236 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -123.01 170.99 9.59 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.467 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 13.9 tp -118.25 127.17 53.48 Favored 'General case' 0 C--N 1.265 -3.103 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.561 ' HA ' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -116.31 121.1 40.99 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.154 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 34.5 mm -106.73 135.57 44.7 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.7 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -173.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.8 m -122.72 148.02 45.8 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.491 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.4 t-20 -75.16 140.79 43.59 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.27 37.37 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.969 0.414 . . . . 0.0 111.278 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.565 ' HA ' HE21 ' A' ' 57' ' ' GLN . 0.0 OUTLIER -95.65 -47.3 6.27 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.855 -176.092 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -90.79 -21.45 21.51 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.164 0.507 . . . . 0.0 109.778 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.9 mmmt 66.74 26.7 9.46 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.475 1.11 . . . . 0.0 109.914 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -91.86 136.18 33.35 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -79.86 147.56 31.69 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.801 0.81 . . . . 0.0 111.382 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -103.9 95.88 6.31 Favored 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.6 p -80.44 -47.38 14.44 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 114.942 -1.026 . . . . 0.0 113.541 -172.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.448 ' O ' HD21 ' A' ' 31' ' ' LEU . 3.1 t70 -94.65 145.94 24.49 Favored 'General case' 0 CA--C 1.487 -1.455 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.397 -175.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.403 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 8.8 p-10 -69.72 -4.35 19.35 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -88.96 -7.11 56.64 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.971 175.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.49 150.41 48.9 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.417 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.78 138.13 52.89 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.598 -0.689 . . . . 0.0 111.609 -174.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -115.3 115.13 42.75 Favored Pre-proline 0 C--N 1.319 -0.732 0 C-N-CA 120.059 -0.657 . . . . 0.0 110.415 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.437 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 94.9 Cg_endo -80.48 153.89 20.93 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 C-N-CA 123.154 2.569 . . . . 0.0 113.19 176.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.4 pttt -59.24 -25.01 63.67 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.68 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -76.57 -5.56 48.21 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -116.13 133.88 55.54 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.408 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.8 m -91.48 137.0 32.71 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.552 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.4 m -128.0 154.14 38.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 CA-C-O 121.481 0.658 . . . . 0.0 111.87 -177.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.92 133.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.27 109.96 29.78 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-O 121.275 0.56 . . . . 0.0 110.326 -175.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -108.57 132.95 53.35 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.558 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 34.7 ttp85 -95.68 129.77 42.78 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.494 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -126.75 156.43 73.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 CA--C 1.54 0.783 0 C-N-CA 122.158 1.905 . . . . 0.0 111.978 178.939 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' A' ' 23' ' ' THR . 30.4 m . . . . . 0 N--CA 1.411 -2.403 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.4 p -139.73 135.6 33.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.517 -177.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.506 ' O ' ' HA ' ' A' ' 21' ' ' THR . 78.9 t -106.9 125.12 62.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -76.91 108.94 10.31 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.533 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 44.5 p90 -127.22 135.63 50.91 Favored 'General case' 0 C--N 1.28 -2.418 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -115.8 136.08 53.4 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.05 160.84 16.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.449 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 16.1 m -58.32 -30.32 66.6 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.53 0.681 . . . . 0.0 110.058 174.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.1 m -86.04 1.61 49.64 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.607 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 138.43 54.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.015 0.912 . . . . 0.0 111.878 177.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -85.96 -27.1 25.12 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -110.2 172.05 7.09 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.611 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -92.11 139.59 30.48 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.224 0.535 . . . . 0.0 112.038 -176.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.13 175.37 5.5 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 173.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.506 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.9 p -137.42 131.3 31.78 Favored 'General case' 0 CA--C 1.48 -1.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.581 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 7.9 p -109.63 125.32 66.79 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 7' ' ' SER . 4.2 p -90.95 140.99 29.31 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.691 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.3 p90 -150.57 174.14 13.31 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -107.02 140.81 39.23 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.54 -175.02 18.55 Favored Glycine 0 C--N 1.298 -1.565 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 tt -90.06 -40.68 12.14 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.533 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -133.45 155.26 49.86 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.969 -1.014 . . . . 0.0 112.15 -178.273 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.3 tt -121.62 126.6 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.522 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.43 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 13.2 m -60.31 146.88 42.43 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.505 177.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.91 -38.12 78.18 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 123.751 0.821 . . . . 0.0 111.399 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.689 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.8 t -55.81 -46.9 77.94 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 175.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 22.2 m-20 -68.61 -41.91 78.87 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.352 -176.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.16 -46.67 70.12 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.035 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.6 mtmt -64.41 -42.86 95.82 Favored 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 121.307 -0.157 . . . . 0.0 111.365 -178.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.689 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.44 -36.82 81.45 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.418 0.449 . . . . 0.0 111.037 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 11.8 mm-40 -71.18 -44.37 65.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.334 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.5 mt -66.87 -40.42 85.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.508 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 59.9 mtt -60.36 -40.01 89.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.523 0.201 . . . . 0.0 110.511 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.8 -39.55 54.86 Favored Glycine 0 N--CA 1.438 -1.231 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.941 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -68.76 -49.55 57.78 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -82.37 -14.15 55.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.018 -173.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.7 mmtm 75.37 65.63 0.07 Allowed 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 125.85 1.66 . . . . 0.0 110.528 -178.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.75 152.64 19.46 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.696 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -104.82 102.13 11.7 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.907 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.37 -7.72 51.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.442 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -9.14 43.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.082 0.467 . . . . 0.0 110.545 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -112.1 -42.53 3.73 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.105 -178.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.8 m -129.86 171.67 12.48 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.03 -176.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.45 170.56 11.28 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.401 ' HG ' ' CD1' ' A' ' 53' ' ' ILE . 18.0 tp -120.9 115.78 23.89 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -173.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.44 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.6 tt0 -114.46 112.89 23.72 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.333 0.587 . . . . 0.0 110.277 -175.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.401 ' CD1' ' HG ' ' A' ' 51' ' ' LEU . 1.8 mp -99.01 135.27 34.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.793 -175.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -124.39 134.92 52.98 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 123.091 0.556 . . . . 0.0 109.513 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.469 ' HA ' HG13 ' A' ' 75' ' ' VAL . 13.2 t-20 -61.41 135.34 57.65 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.422 0.289 . . . . 0.0 110.277 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.41 -25.81 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.975 0.417 . . . . 0.0 111.442 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -93.34 -52.38 4.55 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.917 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.1 p -95.11 -15.84 23.07 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 62.47 26.61 15.84 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.799 0.809 . . . . 0.0 112.13 -174.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -73.17 116.66 13.96 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.29 126.65 34.97 Favored 'General case' 0 N--CA 1.42 -1.968 0 CA-C-O 121.397 0.618 . . . . 0.0 110.592 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -99.3 104.18 16.06 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-N 114.698 -1.137 . . . . 0.0 108.252 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.2 p -113.52 -2.37 13.89 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.745 0.783 . . . . 0.0 110.34 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -106.08 131.93 52.77 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.549 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -65.58 -12.6 54.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-O 121.311 0.576 . . . . 0.0 111.404 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -91.6 2.13 56.67 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.789 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.61 147.79 47.23 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 173.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.533 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.99 138.48 52.79 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.265 0.484 . . . . 0.0 110.979 -176.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.17 113.89 35.24 Favored Pre-proline 0 C--N 1.314 -0.965 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.218 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 69.2 Cg_endo -76.89 152.74 32.46 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.086 2.524 . . . . 0.0 113.379 176.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.9 pttt -59.29 -23.74 62.68 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -78.76 -17.18 56.21 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.792 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.9 m -100.03 139.87 35.07 Favored 'General case' 0 C--N 1.308 -1.201 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.358 -175.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -99.38 136.58 39.11 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.533 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.2 m -130.99 155.84 42.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 120.952 0.406 . . . . 0.0 110.66 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.18 130.82 55.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.0 t -105.78 113.23 42.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.318 -175.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.449 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 37.6 ttm180 -106.31 143.6 34.2 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.957 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -105.28 117.07 33.07 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.44 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -114.5 154.23 46.58 Favored Pre-proline 0 C--N 1.301 -1.535 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.406 -175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 C--N 1.325 -0.692 0 C-N-CA 122.621 2.214 . . . . 0.0 111.367 178.228 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 73.4 m . . . . . 0 N--CA 1.406 -2.637 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 34.4 m -133.1 134.86 44.83 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.069 -172.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 21' ' ' THR . 92.2 t -106.54 134.46 48.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 41.9 m-70 -84.22 123.06 29.71 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 123.775 0.672 . . . . 0.0 109.324 177.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.594 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 53.3 p90 -136.64 142.27 43.23 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.072 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -123.64 116.23 22.76 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 119.801 -0.759 . . . . 0.0 110.232 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.543 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 0.8 OUTLIER -68.77 165.61 19.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.435 -1.257 . . . . 0.0 111.275 178.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.4 m -56.61 -37.1 70.2 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.967 176.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.3 t -106.84 19.78 19.98 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.056 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -99.64 138.4 36.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.69 -31.72 16.48 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.647 0.737 . . . . 0.0 109.708 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -129.94 177.14 7.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -83.34 146.83 28.28 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.062 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.4 t70 -115.2 178.66 4.21 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.492 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -136.57 121.74 19.11 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 118.734 0.697 . . . . 0.0 110.677 -172.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.1 p -95.87 134.68 32.51 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.405 HG21 ' SG ' ' A' ' 8' ' ' CYS . 5.3 p -102.66 126.51 49.78 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.146 0.498 . . . . 0.0 111.494 -175.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 7' ' ' SER . 29.3 p90 -141.29 172.27 12.91 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -106.83 137.5 44.75 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.0 -167.05 12.36 Favored Glycine 0 N--CA 1.429 -1.82 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -98.03 -31.63 12.05 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.605 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.16 147.67 33.99 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -112.16 123.95 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.297 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.9 m -63.97 143.32 57.95 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.953 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.8 tp -54.84 -41.05 70.27 Favored 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 124.684 1.194 . . . . 0.0 112.533 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.633 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 32.2 t -53.18 -45.9 68.74 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 123.219 0.325 . . . . 0.0 110.339 176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.7 -39.8 61.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.523 0.678 . . . . 0.0 110.02 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.77 -47.21 85.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.287 -177.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.534 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.3 mtmt -70.68 -44.76 66.36 Favored 'General case' 0 C--O 1.203 -1.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.218 -178.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.633 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.0 mptp? -61.29 -37.71 84.16 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -175.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -64.64 -45.19 87.84 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.459 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.5 mt -73.95 -41.48 53.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.029 -176.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 88.8 mtp -62.25 -37.64 86.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.708 0.289 . . . . 0.0 110.576 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.46 -42.4 41.31 Favored Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.781 176.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -64.73 -47.65 77.48 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -89.09 11.16 19.24 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.488 -175.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? 55.06 62.09 2.66 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 123.94 0.896 . . . . 0.0 111.169 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -91.61 145.88 24.24 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.567 177.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.514 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -95.13 101.77 13.54 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.58 -8.55 55.78 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.964 -175.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -90.18 -1.73 57.97 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.932 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.488 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 16.6 t70 -129.08 -37.12 1.71 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.453 0.644 . . . . 0.0 110.474 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -128.78 166.12 19.62 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-O 121.814 0.816 . . . . 0.0 112.424 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.47 169.32 12.52 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 126.02 1.728 . . . . 0.0 106.687 176.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 35' ' ' LYS . 20.5 tp -117.42 111.25 19.06 Favored 'General case' 0 N--CA 1.404 -2.749 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.462 HE21 HG23 ' A' ' 80' ' ' ILE . 9.4 tt0 -109.34 111.23 22.67 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.593 0.711 . . . . 0.0 109.853 -178.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.417 ' CD1' HG21 ' A' ' 77' ' ' VAL . 18.7 mm -92.95 136.18 25.68 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -123.37 143.19 50.27 Favored 'General case' 0 C--N 1.275 -2.654 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -68.58 136.22 52.72 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 122.039 -0.413 . . . . 0.0 110.559 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -28.18 64.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -91.21 -58.18 2.54 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 121.186 0.517 . . . . 0.0 111.192 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 p -91.68 -17.44 25.47 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.195 -169.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.94 23.41 12.59 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.621 0.724 . . . . 0.0 112.549 -173.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.03 115.95 7.31 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -87.4 128.15 35.21 Favored 'General case' 0 N--CA 1.413 -2.293 0 CA-C-O 121.874 0.845 . . . . 0.0 110.174 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.2 93.53 8.73 Favored 'General case' 0 C--N 1.267 -2.995 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.062 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.8 p -98.36 -26.83 14.35 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.521 -1.218 . . . . 0.0 111.032 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -90.11 135.17 33.82 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.81 -13.15 62.22 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.895 0.379 . . . . 0.0 111.801 -176.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -83.59 -9.19 59.08 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.155 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.12 136.25 57.67 Favored 'General case' 0 C--O 1.2 -1.513 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.605 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -117.82 137.65 52.61 Favored 'General case' 0 C--N 1.281 -2.391 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.221 -176.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -117.04 118.79 35.74 Favored Pre-proline 0 C--N 1.297 -1.693 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.729 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 72.3 Cg_endo -78.68 157.94 28.23 Favored 'Trans proline' 0 C--N 1.324 -0.718 0 C-N-CA 123.218 2.612 . . . . 0.0 113.404 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 49.6 pttt -70.19 -5.48 27.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.9 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -87.83 -4.27 58.88 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.759 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -122.43 157.94 30.82 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-O 120.973 0.416 . . . . 0.0 111.247 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m -118.86 137.76 53.21 Favored 'General case' 0 N--CA 1.422 -1.837 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 12.5 m -130.48 163.85 35.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.48 0.657 . . . . 0.0 111.697 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 13.9 mm -109.47 132.28 58.05 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.543 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 1.7 p -112.78 106.55 20.99 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 122.173 0.987 . . . . 0.0 111.207 -177.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -103.26 131.79 50.03 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.843 -174.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -90.51 117.57 29.3 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.462 HG23 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -116.6 151.56 47.26 Favored Pre-proline 0 C--N 1.308 -1.219 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -177.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo . . . . . 0 CA--C 1.549 1.248 0 C-N-CA 122.399 2.066 . . . . 0.0 112.362 178.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.433 ' HB3' ' HG2' ' A' ' 71' ' ' LYS . 67.4 m . . . . . 0 N--CA 1.406 -2.657 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.1 p -144.73 135.14 24.37 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.084 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 21' ' ' THR . 69.0 t -106.19 125.63 61.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -81.05 117.31 21.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 124.185 0.928 . . . . 0.0 108.874 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.604 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -133.26 140.55 47.55 Favored 'General case' 0 C--N 1.29 -1.995 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -124.26 140.92 52.5 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.62 165.68 18.8 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 m -56.55 -37.36 70.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.812 0.815 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.92 -3.87 55.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.573 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -110.52 143.34 41.01 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.9 tp -94.99 -37.73 11.0 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.573 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -99.97 158.02 16.12 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.391 -0.523 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.65 137.14 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 116.07 -0.514 . . . . 0.0 112.039 -176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -95.31 174.7 6.91 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 171.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -138.34 133.91 33.58 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -175.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.3 m -94.9 114.92 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 171.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -90.21 114.41 26.39 Favored 'General case' 0 N--CA 1.41 -2.46 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.152 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 9' ' ' VAL . 5.5 p90 -135.83 165.39 25.73 Favored 'General case' 0 C--N 1.282 -2.327 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -177.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 6.01 32.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -174.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.48 -178.52 45.37 Favored Glycine 0 C--N 1.285 -2.25 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.577 177.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -89.78 -39.84 12.86 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.47 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.81 153.27 44.4 Favored 'General case' 0 CA--C 1.488 -1.437 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.045 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.0 tt -123.47 129.41 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.242 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.711 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -63.11 145.0 56.41 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.234 178.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.1 tp -54.99 -44.43 74.48 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.502 1.121 . . . . 0.0 112.981 -176.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.541 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.8 t -57.0 -45.58 82.9 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.148 0.499 . . . . 0.0 109.755 178.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.523 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 9.4 m-20 -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.146 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.77 95.96 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.04 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 54.7 mtmt -63.11 -41.55 99.38 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.252 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.61 -37.46 84.0 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.593 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -66.03 -50.23 64.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.083 0.468 . . . . 0.0 109.796 178.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.32 -43.36 91.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.632 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.7 mtm -66.02 -34.99 79.35 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.222 -0.191 . . . . 0.0 111.264 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.2 -39.98 51.12 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.496 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.47 -48.03 68.36 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 123.375 0.67 . . . . 0.0 112.151 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -91.49 2.11 56.66 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.316 -174.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.39 65.45 1.17 Allowed 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 124.444 1.098 . . . . 0.0 111.28 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -95.09 173.55 7.52 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.21 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.448 ' HG3' ' SG ' ' A' ' 49' ' ' CYS . 16.8 ptpt -105.95 101.33 10.83 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.334 178.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.92 -13.29 59.89 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.384 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.58 4.68 45.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.997 0.427 . . . . 0.0 111.211 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -124.72 -40.53 2.19 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.391 0.615 . . . . 0.0 109.464 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.448 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 24.4 p -134.03 164.35 27.52 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.963 -178.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -116.12 170.36 8.56 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.8 tp -115.43 123.71 49.3 Favored 'General case' 0 C--N 1.267 -3.019 0 CA-C-O 121.456 0.646 . . . . 0.0 109.283 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.491 ' HB2' HG12 ' A' ' 80' ' ' ILE . 5.1 tp-100 -103.4 123.94 47.78 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -177.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -116.79 127.83 74.32 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.3 m -115.73 146.89 41.5 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.525 ' HA ' HG13 ' A' ' 75' ' ' VAL . 13.8 t-20 -77.0 138.14 39.42 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.16 -21.42 46.48 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.683 0.754 . . . . 0.0 110.987 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -98.53 -56.23 2.52 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.927 -175.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.9 p -85.93 -19.65 30.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.553 0.692 . . . . 0.0 109.672 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.1 mmtp 63.45 21.07 12.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.914 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -77.89 129.51 35.46 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -93.62 127.82 39.49 Favored 'General case' 0 N--CA 1.416 -2.13 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -94.65 96.0 9.13 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -92.54 -21.14 20.28 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.025 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.631 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 12.8 m-20 -97.92 133.35 42.52 Favored 'General case' 0 CA--C 1.492 -1.275 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.412 ' HA ' HD22 ' A' ' 31' ' ' LEU . 3.1 p30 -73.39 -4.07 31.22 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -175.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.631 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 6.9 p30 -85.35 -10.05 56.83 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.043 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.0 146.11 48.28 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.47 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.45 137.42 52.52 Favored 'General case' 0 C--N 1.289 -2.041 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.328 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.65 114.44 39.92 Favored Pre-proline 0 N--CA 1.435 -1.193 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.065 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 72.0 Cg_endo -78.89 156.67 27.16 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.166 2.577 . . . . 0.0 112.389 176.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.62 -7.48 33.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.925 0.869 . . . . 0.0 111.811 178.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -83.43 -11.88 57.04 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.39 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.9 m -112.58 152.25 29.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 120.888 0.375 . . . . 0.0 111.366 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.9 m -109.9 132.42 54.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 173.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.8 m -127.39 160.52 36.37 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -175.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.1 mm -112.29 132.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.0 t -109.24 129.71 63.51 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 CA-C-O 121.086 0.47 . . . . 0.0 110.789 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.405 ' HB3' ' HB3' ' A' ' 52' ' ' GLN . 29.4 ttm180 -126.61 152.26 46.88 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 125.225 1.41 . . . . 0.0 107.744 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -110.24 127.74 55.14 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.491 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.9 pp -132.59 161.58 62.43 Favored Pre-proline 0 C--O 1.21 -0.995 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.693 -175.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo . . . . . 0 N--CA 1.48 0.728 0 C-N-CA 122.362 2.041 . . . . 0.0 112.12 177.588 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 46.0 m . . . . . 0 N--CA 1.424 -1.739 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.624 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.6 p -147.78 142.41 26.6 Favored 'General case' 0 N--CA 1.422 -1.826 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.608 -175.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.427 HG22 ' CE1' ' A' ' 24' ' ' PHE . 87.8 t -107.18 136.55 41.87 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 178.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -83.32 109.54 17.36 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.572 ' CE1' HG12 ' A' ' 22' ' ' VAL . 30.9 p90 -124.81 140.2 53.14 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 19' ' ' TYR . 63.8 pttt -125.68 123.2 38.38 Favored 'General case' 0 C--N 1.293 -1.872 0 C-N-CA 118.443 -1.303 . . . . 0.0 110.956 174.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.541 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 1.4 t80 -84.34 172.44 11.79 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.276 -176.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -64.13 -27.0 68.78 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.563 0.697 . . . . 0.0 109.232 170.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.7 m -82.57 -20.32 36.77 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.338 178.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.482 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 0.9 OUTLIER -111.65 101.46 9.85 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.672 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.76 -33.27 75.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.592 0.71 . . . . 0.0 110.646 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -114.36 169.19 9.22 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.633 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.407 ' HA ' ' HB3' ' A' ' 12' ' ' LYS . 98.5 m-85 -70.5 147.64 49.15 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -121.88 177.35 5.33 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 104.615 -2.365 . . . . 0.0 104.615 176.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.8 p -135.64 127.19 28.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -95.97 114.95 33.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.574 171.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' A' ' 7' ' ' SER . 2.2 p -85.47 124.86 32.54 Favored 'General case' 0 N--CA 1.418 -2.045 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.512 ' O ' ' HB2' ' A' ' 7' ' ' SER . 38.5 p90 -142.28 176.68 8.8 Favored 'General case' 0 N--CA 1.434 -1.266 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -105.35 136.66 44.48 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.687 0.279 . . . . 0.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.95 -147.74 18.5 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.533 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.33 -39.8 4.32 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.462 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -138.75 157.86 45.3 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.432 -179.069 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -128.35 129.43 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.092 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.336 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.8 m -61.66 148.08 43.76 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.054 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.426 HD22 ' O ' ' A' ' 64' ' ' ASP . 51.7 tp -57.48 -41.53 80.87 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 124.186 0.994 . . . . 0.0 112.547 -176.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.667 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 48.0 t -55.61 -46.47 77.33 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.498 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 4.5 m-20 -69.88 -42.57 73.27 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.28 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 124.03 0.932 . . . . 0.0 110.361 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.9 mtmt -67.19 -38.3 85.15 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.566 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.667 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 1.6 mptm? -61.39 -36.57 80.64 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -64.4 -50.09 69.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 109.491 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.2 mt -73.01 -41.4 59.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.471 -174.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.4 mtt -59.94 -44.43 94.37 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 110.455 -0.202 . . . . 0.0 110.455 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.78 -33.7 71.29 Favored Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.727 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -71.92 -46.44 57.61 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -91.5 -1.5 57.51 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 120.858 0.361 . . . . 0.0 111.943 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.407 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 26.4 mmtm 66.93 66.96 0.42 Allowed 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 125.08 1.352 . . . . 0.0 110.363 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.81 170.01 9.61 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -112.46 101.72 9.87 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.099 175.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.15 -6.6 59.54 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.364 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.94 -3.97 53.56 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.389 0.614 . . . . 0.0 110.171 177.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -128.68 -30.3 2.31 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.58 0.705 . . . . 0.0 111.486 -177.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.6 m -132.06 157.24 44.67 Favored 'General case' 0 N--CA 1.414 -2.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.38 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.5 t0 -120.01 162.19 19.66 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 53' ' ' ILE . 21.3 tp -108.92 108.13 18.77 Favored 'General case' 0 C--N 1.257 -3.429 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 -177.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.426 ' CA ' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -97.53 116.66 30.17 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-O 121.693 0.759 . . . . 0.0 109.249 -174.813 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.453 ' CD1' HG11 ' A' ' 77' ' ' VAL . 21.2 mm -105.26 130.52 56.36 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.757 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 m -125.02 141.59 52.03 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.59 128.9 38.51 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 122.594 0.357 . . . . 0.0 110.955 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.87 -29.51 65.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.24 0.543 . . . . 0.0 110.341 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -87.78 -58.11 2.69 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.862 -177.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.4 p -90.64 -14.28 32.66 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -171.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.17 21.69 12.98 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 123.344 0.658 . . . . 0.0 112.769 -172.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -74.74 121.87 22.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -92.31 119.54 31.99 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.471 ' CZ ' HG13 ' A' ' 69' ' ' ILE . 87.7 m-85 -55.72 -65.29 0.62 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 123.645 0.778 . . . . 0.0 112.416 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.8 p 74.41 -36.8 0.34 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 127.802 2.441 . . . . 0.0 114.631 171.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' HD22 ' A' ' 31' ' ' LEU . 4.6 t70 -95.49 132.88 40.12 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -174.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.49 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 9.5 m-20 -65.27 -14.18 60.14 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.24 0.543 . . . . 0.0 111.703 -175.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -91.97 -1.97 56.99 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.48 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.49 145.1 47.76 Favored 'General case' 0 C--O 1.194 -1.836 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.462 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.53 138.32 51.98 Favored 'General case' 0 C--N 1.288 -2.104 0 CA-C-N 118.825 0.739 . . . . 0.0 111.399 -173.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.471 HG13 ' CZ ' ' A' ' 62' ' ' TYR . 3.2 mp -114.06 115.51 45.5 Favored Pre-proline 0 C--N 1.312 -1.042 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.448 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 92.3 Cg_endo -81.11 159.62 20.57 Favored 'Trans proline' 0 C--N 1.324 -0.761 0 C-N-CA 123.116 2.544 . . . . 0.0 113.479 175.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -73.35 4.83 4.18 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.966 176.049 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -87.54 -19.07 28.39 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.0 m -109.63 162.31 14.55 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.625 0.726 . . . . 0.0 112.765 -173.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.4 m -121.51 130.56 53.62 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.6 m -129.01 158.79 41.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.4 mm -99.69 129.17 50.68 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 59.9 t -109.74 111.48 36.33 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 CA-C-O 121.556 0.693 . . . . 0.0 109.46 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.0 ttp-105 -121.23 136.34 54.99 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.824 -174.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -93.08 128.35 38.95 Favored 'General case' 0 C--N 1.292 -1.899 0 O-C-N 121.954 -0.466 . . . . 0.0 110.216 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pp -125.72 152.37 72.16 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 C--N 1.326 -0.649 0 C-N-CA 122.153 1.902 . . . . 0.0 111.117 177.003 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.516 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 49.5 m . . . . . 0 N--CA 1.408 -2.545 0 CA-C-O 120.671 0.272 . . . . 0.0 110.411 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.3 p -145.01 141.77 29.21 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.007 -178.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG22 ' CE1' ' A' ' 24' ' ' PHE . 87.2 t -107.02 129.9 59.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -80.61 110.85 16.49 Favored 'General case' 0 CA--C 1.491 -1.293 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 174.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.595 ' OH ' ' HG2' ' A' ' 41' ' ' ARG . 37.6 p90 -131.9 146.37 52.07 Favored 'General case' 0 C--N 1.28 -2.449 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -130.55 141.98 50.47 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -89.81 169.35 11.34 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.2 m -56.93 -37.01 70.89 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.999 0.428 . . . . 0.0 111.297 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.7 m -90.99 4.02 53.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -117.62 125.93 51.62 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.0 tt -83.26 -42.0 17.7 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.2 157.81 20.53 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -88.44 146.78 25.03 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 120.964 0.411 . . . . 0.0 110.698 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -112.06 174.76 5.73 Favored 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 p -139.37 115.71 10.5 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.144 0.497 . . . . 0.0 111.238 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.8 p -95.86 120.85 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.082 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 177.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.0 p -87.95 140.24 29.7 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.449 ' CE1' HG22 ' A' ' 9' ' ' VAL . 33.8 p90 -151.94 170.89 18.75 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -178.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -102.45 138.29 39.57 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.09 -173.91 17.06 Favored Glycine 0 N--CA 1.433 -1.509 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -88.66 -31.32 18.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.537 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -147.69 157.5 43.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -175.417 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 tt -121.73 128.5 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.247 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 16.3 m -63.79 147.09 52.65 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.223 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.2 tp -57.81 -42.77 84.97 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 124.019 0.927 . . . . 0.0 112.419 -176.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -54.25 -45.17 72.33 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.609 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 19.2 m-20 -68.23 -49.69 59.01 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.463 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.2 -45.47 91.0 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.822 -1.081 . . . . 0.0 112.746 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HA ' HD21 ' A' ' 51' ' ' LEU . 51.9 mtmt -63.05 -41.49 99.49 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.785 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.3 mptp? -61.58 -38.48 87.68 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 120.664 0.268 . . . . 0.0 110.373 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 15.4 mm100 -68.15 -50.15 56.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.69 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.8 mt -70.47 -39.07 75.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.7 mtm -64.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.967 178.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.36 -35.53 56.29 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.449 175.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.595 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 25.3 tpt180 -61.06 -51.17 70.31 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.197 0.999 . . . . 0.0 111.9 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.38 -1.12 54.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.86 0.362 . . . . 0.0 111.856 -176.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm 66.22 68.5 0.44 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 125.092 1.357 . . . . 0.0 110.48 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -95.52 158.22 15.55 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.793 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.41 ' HD3' ' HB2' ' A' ' 48' ' ' ASP . 8.1 ptpp? -85.1 101.04 12.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 170.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.72 -7.49 59.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -169.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.22 -12.85 17.7 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.705 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.41 ' HB2' ' HD3' ' A' ' 45' ' ' LYS . 4.0 m-20 -105.93 -16.5 14.62 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -175.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -148.03 170.29 18.07 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -120.94 164.9 16.0 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 35' ' ' LYS . 19.5 tp -116.27 113.62 23.24 Favored 'General case' 0 N--CA 1.405 -2.724 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.469 ' HB2' HG12 ' A' ' 80' ' ' ILE . 33.8 tt0 -111.13 112.0 23.49 Favored 'General case' 0 C--N 1.281 -2.402 0 CA-C-O 121.781 0.801 . . . . 0.0 109.23 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.425 ' CD1' HG12 ' A' ' 77' ' ' VAL . 29.0 mm -90.53 135.77 25.68 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.48 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.663 -172.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 14.9 m -117.88 145.33 44.7 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.561 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.4 t-20 -74.73 141.98 44.42 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -84.97 -27.52 26.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.715 0.769 . . . . 0.0 110.62 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -85.03 -48.68 8.99 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.559 -175.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -98.1 -20.27 17.45 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.252 0.548 . . . . 0.0 110.076 -176.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 60.79 36.96 19.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.675 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -101.27 132.57 46.72 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.429 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 1.1 mp0 -81.69 148.11 29.16 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-O 121.878 0.847 . . . . 0.0 112.36 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -108.14 101.11 10.37 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 173.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.8 p -97.97 -27.26 14.33 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.286 0.565 . . . . 0.0 112.013 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -91.01 128.46 36.84 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -177.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -66.96 -6.26 16.05 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -95.32 1.77 54.52 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.749 178.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.53 152.72 43.67 Favored 'General case' 0 C--O 1.207 -1.182 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 173.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.537 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.83 138.29 52.82 Favored 'General case' 0 C--N 1.289 -2.031 0 O-C-N 121.77 -0.581 . . . . 0.0 111.473 -178.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.49 117.16 38.55 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.223 175.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.449 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 74.0 Cg_endo -80.21 161.17 23.21 Favored 'Trans proline' 0 C--N 1.328 -0.523 0 C-N-CA 123.522 2.815 . . . . 0.0 114.064 177.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.516 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 47.4 pttt -67.62 -16.37 64.13 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.222 176.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -70.87 -25.64 62.89 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.796 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.8 m -98.32 159.68 14.79 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-O 121.639 0.733 . . . . 0.0 112.17 -173.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.9 m -124.01 127.87 48.54 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 173.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.501 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 21.9 m -125.38 155.0 34.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 CA-C-O 121.593 0.711 . . . . 0.0 112.8 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.4 mm -104.16 127.84 58.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.425 HG12 ' CD1' ' A' ' 53' ' ' ILE . 60.0 t -99.46 111.58 29.46 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.519 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.359 -175.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -110.55 130.93 55.45 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.889 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -89.75 127.55 35.97 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.469 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.85 150.11 55.04 Favored Pre-proline 0 C--N 1.305 -1.364 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.085 -178.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo . . . . . 0 N--CA 1.448 -1.165 0 C-N-CA 122.063 1.842 . . . . 0.0 112.196 178.838 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.487 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.1 m . . . . . 0 N--CA 1.414 -2.264 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.5 p -127.29 128.61 46.25 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.075 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.484 ' CG2' ' HA ' ' A' ' 71' ' ' LYS . 41.2 t -106.93 131.05 57.88 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -86.64 112.7 21.86 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.1 p90 -126.2 133.23 51.59 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.867 -177.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -118.35 135.74 54.14 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.134 -1.026 . . . . 0.0 108.962 175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.513 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 1.2 t80 -92.52 165.34 13.07 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -176.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -56.86 -31.95 65.32 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.45 0.643 . . . . 0.0 109.799 175.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.5 m -82.68 -8.73 59.58 Favored 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.959 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.513 ' HD2' ' H ' ' A' ' 13' ' ' PHE . 65.5 mttm -108.66 146.33 33.6 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 121.928 -0.483 . . . . 0.0 110.72 -177.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.4 tp -92.65 -46.19 7.71 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 171.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -97.24 155.87 16.67 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.778 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -75.8 135.96 40.25 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 121.305 0.574 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -94.74 177.85 5.78 Favored 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -137.48 128.11 26.85 Favored 'General case' 0 C--N 1.28 -2.44 0 CA-C-N 118.432 0.56 . . . . 0.0 111.462 -174.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -113.22 136.28 50.07 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.0 p -112.28 138.76 48.52 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 120.849 0.357 . . . . 0.0 111.517 -178.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -151.57 176.3 11.48 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.69 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -103.82 150.11 24.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 175.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.07 161.52 34.19 Favored Glycine 0 C--N 1.303 -1.296 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 tt -71.88 -32.79 67.79 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 118.074 0.937 . . . . 0.0 108.841 -177.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.499 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -138.5 159.8 41.16 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.369 -176.142 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.8 tt -128.66 128.15 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.593 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -56.83 142.27 41.53 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.893 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.2 tp -58.23 -34.77 70.8 Favored 'General case' 0 N--CA 1.419 -1.994 0 C-N-CA 124.738 1.215 . . . . 0.0 110.727 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.694 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 11.7 t -58.36 -46.49 86.2 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -74.42 -41.46 60.84 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.613 -176.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.0 -47.34 85.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.001 1.32 . . . . 0.0 111.275 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.5 mtmt -67.05 -43.29 83.08 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 120.535 0.207 . . . . 0.0 111.021 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.92 -35.19 77.67 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.83 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.03 -49.95 72.62 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 120.881 0.372 . . . . 0.0 110.152 175.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.8 mt -69.17 -44.85 80.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.739 -175.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 73.8 mtm -66.05 -39.89 90.49 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.238 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.24 -37.11 86.22 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.038 -1.077 . . . . 0.0 111.221 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -65.43 -49.03 70.69 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 123.065 0.546 . . . . 0.0 111.836 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 46.5 mt-10 -103.34 19.6 19.36 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.8 mmtt 62.16 34.11 16.44 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.676 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 7.8 mp -71.96 132.77 44.77 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.068 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.427 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 16.4 ptpt -71.86 101.4 2.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 122.144 0.973 . . . . 0.0 111.293 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.71 -7.91 57.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.896 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.83 -0.4 45.23 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.574 0.702 . . . . 0.0 110.349 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.427 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 9.3 t70 -113.05 -41.18 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.032 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -133.34 166.7 21.89 Favored 'General case' 0 N--CA 1.415 -2.225 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.459 -174.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -116.86 166.66 11.9 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.473 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 14.2 tp -112.79 125.45 54.36 Favored 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.501 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -111.52 109.04 18.77 Favored 'General case' 0 C--N 1.284 -2.277 0 O-C-N 121.777 -0.577 . . . . 0.0 109.709 -177.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.44 ' CD1' ' HG ' ' A' ' 51' ' ' LEU . 1.9 mp -99.69 125.65 53.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 CA-C-O 121.388 0.613 . . . . 0.0 110.084 -176.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.9 m -115.22 137.1 52.39 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.578 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.7 t-20 -67.15 138.24 56.89 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.76 -20.82 41.83 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.499 0.666 . . . . 0.0 111.263 -177.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -98.83 -47.33 5.33 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.384 -174.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 42.8 p -95.15 -22.59 17.76 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.4 0.619 . . . . 0.0 109.938 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.578 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 69.68 21.58 6.51 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 125.394 1.478 . . . . 0.0 111.538 -175.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.52 119.53 12.47 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.669 -1.151 . . . . 0.0 108.419 176.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -90.16 121.02 31.82 Favored 'General case' 0 N--CA 1.411 -2.386 0 CA-C-O 121.522 0.677 . . . . 0.0 110.889 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -93.21 100.77 13.08 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -100.64 -22.34 14.96 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.768 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -99.94 137.87 37.79 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.1 m-20 -60.03 -19.55 53.26 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -78.4 -8.73 58.8 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.9 152.16 45.1 Favored 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.4 138.6 52.98 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 118.604 0.638 . . . . 0.0 112.516 -176.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.21 115.23 38.28 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.57 173.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 47.3 Cg_endo -77.76 151.39 28.15 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.991 2.46 . . . . 0.0 113.016 174.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.484 ' HA ' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -67.18 -10.87 54.79 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.973 0.892 . . . . 0.0 113.294 -177.714 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -87.18 -4.77 59.13 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.875 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.6 m -109.73 143.15 39.92 Favored 'General case' 0 N--CA 1.426 -1.648 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.1 m -103.58 129.08 50.75 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 55' ' ' ASN . 29.5 m -124.45 159.59 30.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -174.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -101.39 134.49 41.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.1 t -114.58 114.44 46.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 CA-C-O 121.053 0.454 . . . . 0.0 109.784 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -113.62 132.29 55.81 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.613 -177.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -85.96 121.88 29.22 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.501 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -123.25 147.99 53.67 Favored Pre-proline 0 C--O 1.206 -1.221 0 C-N-CA 120.551 -0.46 . . . . 0.0 109.916 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--N 1.31 -1.45 0 C-N-CA 121.989 1.793 . . . . 0.0 111.255 179.573 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 18.0 m . . . . . 0 N--CA 1.402 -2.851 0 CA-C-O 121.653 0.74 . . . . 0.0 111.113 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -138.69 129.04 25.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.091 -177.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 21' ' ' THR . 51.3 t -107.23 132.12 55.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.518 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 49.4 m-70 -80.8 108.83 14.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.57 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 32.8 p90 -124.37 137.48 54.46 Favored 'General case' 0 C--N 1.281 -2.373 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -120.32 133.29 55.48 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 174.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -88.88 153.71 20.83 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 -177.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.2 p -68.45 -12.45 61.21 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.383 0.611 . . . . 0.0 111.484 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.9 p -87.78 -9.72 53.11 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.307 0.575 . . . . 0.0 109.884 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -113.66 -176.96 3.02 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.3 tp -134.23 -20.69 1.88 Allowed 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.346 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -104.77 157.37 17.24 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.23 147.68 27.86 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.455 175.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.518 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 6.9 t70 -123.43 178.69 5.04 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 5.6 p -130.05 115.41 17.06 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 118.551 0.614 . . . . 0.0 110.916 -173.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.57 ' HB ' ' CE1' ' A' ' 11' ' ' TYR . 10.0 p -95.54 135.62 29.08 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.018 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 7' ' ' SER . 10.0 p -105.46 146.04 30.04 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -174.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 7' ' ' SER . 24.5 p90 -156.51 176.44 12.7 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -113.06 135.0 54.27 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 173.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.53 177.43 16.32 Favored Glycine 0 N--CA 1.425 -2.04 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -81.47 -32.41 32.54 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.623 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -148.99 160.08 43.64 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.973 -175.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.4 tt -126.24 128.01 71.22 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.008 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.8 m -61.94 147.93 45.28 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.35 0.66 . . . . 0.0 111.093 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 43.5 tp -54.67 -46.34 74.01 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.48 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -56.05 -45.31 79.26 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 120.969 0.414 . . . . 0.0 109.959 179.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.04 -41.23 82.39 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.611 0.719 . . . . 0.0 111.073 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.8 -46.8 87.95 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.555 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' HD22 ' A' ' 51' ' ' LEU . 57.9 mtmt -66.11 -39.39 89.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.828 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.7 mptp? -61.63 -39.38 91.1 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.227 0.329 . . . . 0.0 111.488 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -66.62 -47.69 71.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.273 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.11 -47.39 78.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.4 mtm -64.72 -38.26 90.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.908 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.55 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.925 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -71.92 -50.14 31.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.079 0.466 . . . . 0.0 111.327 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.32 -9.75 58.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.486 -173.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm 71.71 62.29 0.15 Allowed 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 125.316 1.446 . . . . 0.0 110.564 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.03 158.36 15.59 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.044 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -106.83 104.41 14.09 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 122.171 0.986 . . . . 0.0 109.706 176.844 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.65 61.8 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.158 -176.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.49 58.09 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.188 0.518 . . . . 0.0 110.782 178.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.469 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 19.2 t70 -117.04 -39.61 3.21 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.727 0.775 . . . . 0.0 110.102 178.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.5 p -138.8 160.81 38.78 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.833 -174.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -115.31 167.39 10.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 35' ' ' LYS . 20.0 tp -114.57 109.82 18.85 Favored 'General case' 0 N--CA 1.404 -2.747 0 CA-C-O 121.502 0.668 . . . . 0.0 109.62 -174.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.482 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.0 tt0 -94.15 120.78 34.88 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -176.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -109.02 130.87 61.21 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.472 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -176.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.8 m -120.38 147.54 44.92 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.6 t-20 -78.33 138.67 38.68 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.07 37.77 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.444 0.64 . . . . 0.0 110.933 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -95.79 -51.89 4.31 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.594 -173.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -89.73 -18.27 26.68 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.524 0.678 . . . . 0.0 109.789 -176.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.6 mmmt 65.4 24.13 12.01 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.078 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -84.75 129.45 34.82 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -85.87 127.42 34.58 Favored 'General case' 0 N--CA 1.417 -2.086 0 CA-C-O 121.626 0.727 . . . . 0.0 109.716 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.14 93.91 8.25 Favored 'General case' 0 C--N 1.272 -2.765 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.074 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -88.36 -28.35 21.03 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.342 -1.299 . . . . 0.0 113.446 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' HB3' HD21 ' A' ' 66' ' ' ASN . 3.6 t70 -99.9 146.08 27.07 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -178.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.34 -5.95 42.98 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.407 HD21 ' HB3' ' A' ' 64' ' ' ASP . 1.0 OUTLIER -85.5 -11.76 53.42 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.888 179.149 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 31' ' ' LEU . . . -60.71 114.08 2.82 Favored 'General case' 0 C--O 1.203 -1.345 0 O-C-N 124.074 0.859 . . . . 0.0 111.298 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.623 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -91.6 138.65 31.4 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.443 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.73 115.6 43.78 Favored Pre-proline 0 C--N 1.301 -1.5 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.669 173.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.432 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 71.6 Cg_endo -79.57 158.5 25.31 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.449 2.766 . . . . 0.0 113.232 176.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -68.48 -4.33 14.6 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.617 178.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -86.74 -11.09 52.12 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.209 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.6 m -118.71 154.33 32.93 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 m -109.37 131.76 54.77 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.43 HG11 ' HA ' ' A' ' 55' ' ' ASN . 19.0 m -126.11 157.44 36.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-O 121.854 0.835 . . . . 0.0 112.882 -175.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mm -99.23 127.25 52.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.3 t -108.45 114.31 46.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.382 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -118.4 138.64 52.31 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.566 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -93.33 122.92 36.24 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.482 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -124.08 153.8 68.05 Favored Pre-proline 0 C--N 1.31 -1.149 0 O-C-N 122.195 -0.315 . . . . 0.0 110.596 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo . . . . . 0 C--N 1.323 -0.776 0 C-N-CA 121.828 1.685 . . . . 0.0 111.199 178.956 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.401 -2.901 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.1 p -133.39 134.6 43.9 Favored 'General case' 0 C--N 1.294 -1.829 0 C-N-CA 120.22 -0.592 . . . . 0.0 111.41 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.0 t -107.32 123.42 62.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.861 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -78.3 114.36 17.12 Favored 'General case' 0 N--CA 1.419 -2.001 0 O-C-N 124.152 0.907 . . . . 0.0 108.907 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.507 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 50.0 p90 -125.05 131.94 53.28 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -117.37 131.22 56.82 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 118.404 -1.318 . . . . 0.0 109.304 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.444 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -86.17 156.68 20.23 Favored 'General case' 0 C--N 1.273 -2.748 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -177.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.3 p -60.26 -27.79 67.53 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.243 0.544 . . . . 0.0 110.527 175.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.6 m -96.78 8.43 44.33 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.703 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.444 ' HD3' ' CB ' ' A' ' 13' ' ' PHE . 5.9 mptp? -108.69 157.16 18.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.11 -34.24 13.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.197 0.522 . . . . 0.0 110.52 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -133.37 175.98 8.93 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -77.11 141.82 40.03 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.336 0.589 . . . . 0.0 111.38 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -108.33 177.31 4.83 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 p -136.79 136.47 38.88 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -175.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -98.72 122.27 50.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 167.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.0 p -93.86 123.54 37.28 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -140.94 177.36 8.1 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -120.27 118.59 30.84 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.461 0.573 . . . . 0.0 112.355 -175.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 134.69 -113.89 1.2 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.86 174.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -131.48 -45.23 0.99 Allowed 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.599 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -141.18 161.66 37.35 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -125.16 127.75 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.133 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.8 m -58.83 137.92 57.51 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.525 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.42 HD13 ' CG1' ' A' ' 53' ' ' ILE . 53.2 tp -54.79 -41.7 70.88 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 124.432 1.093 . . . . 0.0 112.672 -175.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 8.1 t -57.42 -45.42 84.64 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.2 t70 -66.41 -42.36 87.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -64.94 -46.87 79.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.883 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 41.3 mtmt -69.04 -37.89 78.84 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.813 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.7 mptt -61.84 -39.49 92.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.003 177.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 74.7 mt-30 -64.02 -50.88 66.71 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.018 177.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.79 -46.59 96.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.854 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.3 mtm -64.92 -38.34 90.63 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.879 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.86 -33.31 57.84 Favored Glycine 0 C--N 1.315 -0.636 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.156 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -72.96 -48.49 36.26 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 123.463 0.705 . . . . 0.0 112.013 -177.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -95.47 -0.45 52.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.166 0.508 . . . . 0.0 112.125 -173.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 44.5 mmtt 67.35 68.23 0.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.904 177.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.1 170.74 8.7 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.075 178.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -109.88 101.7 10.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.501 0.667 . . . . 0.0 110.106 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.15 -9.04 59.87 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 123.683 0.793 . . . . 0.0 111.271 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.3 -5.63 54.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -131.54 -29.82 1.72 Allowed 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.06 0.933 . . . . 0.0 110.814 -176.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.5 m -130.01 159.35 36.96 Favored 'General case' 0 N--CA 1.399 -3.004 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -176.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -118.36 169.56 9.64 Favored 'General case' 0 C--N 1.287 -2.119 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.483 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 24.0 tp -114.15 119.02 35.68 Favored 'General case' 0 C--N 1.248 -3.812 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.44 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.5 tt0 -113.22 117.2 31.21 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 -175.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.42 ' CG1' HD13 ' A' ' 31' ' ' LEU . 39.2 mm -99.91 135.55 35.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.695 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -176.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 m -123.65 145.36 49.01 Favored 'General case' 0 C--N 1.287 -2.145 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.474 ' HA ' HG11 ' A' ' 75' ' ' VAL . 14.3 t-20 -71.17 139.29 50.14 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.766 -0.584 . . . . 0.0 109.915 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.22 56.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.921 0.391 . . . . 0.0 111.336 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -94.69 -48.29 6.13 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.69 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.2 p -95.31 -19.24 20.14 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.769 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 59.58 41.62 18.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -94.94 126.63 40.4 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -80.87 135.42 35.92 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-O 120.848 0.356 . . . . 0.0 110.238 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -94.0 100.45 12.58 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -83.2 -47.32 11.69 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.682 -1.145 . . . . 0.0 114.06 -170.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -90.97 147.48 23.07 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -78.11 -1.43 32.45 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.298 0.57 . . . . 0.0 112.306 -176.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -92.79 -2.43 55.96 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.943 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.55 148.64 51.39 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 174.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.599 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -118.91 138.76 52.54 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 118.237 0.471 . . . . 0.0 111.634 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.26 117.25 36.81 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.239 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 73.4 Cg_endo -78.34 154.43 28.2 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 123.779 2.986 . . . . 0.0 114.514 177.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -65.05 -10.52 30.69 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.397 1.079 . . . . 0.0 111.776 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.57 -10.46 51.5 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.049 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.9 m -107.57 155.37 20.19 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.291 0.567 . . . . 0.0 111.435 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -118.85 132.91 56.13 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 173.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.507 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 18.8 m -128.64 162.38 35.64 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -104.45 132.84 50.12 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.437 ' CG1' HD12 ' A' ' 51' ' ' LEU . 42.8 t -106.46 113.96 44.43 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.178 0 CA-C-O 121.206 0.526 . . . . 0.0 110.015 -178.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 24.8 tpp180 -110.38 125.11 52.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.102 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -90.28 120.21 31.23 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 174.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.44 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.03 152.25 50.08 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.683 -176.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo . . . . . 0 C--O 1.245 0.856 0 C-N-CA 122.212 1.941 . . . . 0.0 111.053 176.244 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.422 -1.872 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.6 p -137.36 138.9 40.4 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.528 -179.297 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 21' ' ' THR . 41.5 t -107.38 134.98 47.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.467 -179.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -82.95 109.68 17.27 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 174.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.413 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.6 p90 -122.5 134.4 54.57 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -115.74 132.11 56.73 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 117.744 -1.583 . . . . 0.0 109.174 175.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.31 155.65 17.4 Favored 'General case' 0 C--N 1.275 -2.645 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -62.62 -25.8 68.29 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.578 0.704 . . . . 0.0 110.655 175.601 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.1 -3.09 50.83 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.984 178.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -106.31 172.39 6.84 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.8 tp -102.1 -45.8 5.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 176.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -122.69 -171.01 2.19 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.167 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.9 148.1 34.73 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.496 0.665 . . . . 0.0 111.623 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -114.45 178.51 4.26 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 176.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 3.1 p -132.17 131.97 42.75 Favored 'General case' 0 N--CA 1.414 -2.242 0 CA-C-N 118.908 0.776 . . . . 0.0 110.64 -175.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.6 p -110.2 130.77 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.191 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 176.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -102.03 141.94 34.1 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -174.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -155.76 177.38 11.46 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -116.86 155.49 28.93 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.13 -135.64 12.96 Favored Glycine 0 C--N 1.31 -0.912 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 -178.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.441 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 2.8 tm? -122.9 -42.84 2.27 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.489 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.586 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -136.29 159.01 43.05 Favored 'General case' 0 CA--C 1.478 -1.804 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.662 -177.274 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -121.21 126.71 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.638 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.5 m -57.64 140.53 50.91 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.178 176.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -57.87 -40.26 79.78 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 123.17 0.588 . . . . 0.0 112.491 -176.319 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.676 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 19.7 t -55.18 -46.92 75.84 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -66.03 -47.7 73.56 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.74 179.611 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.91 -46.61 89.97 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 123.561 0.538 . . . . 0.0 112.14 -177.066 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -66.08 -45.13 82.34 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.302 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.676 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -62.0 -35.56 78.89 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.271 0.357 . . . . 0.0 111.1 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 29.3 mm-40 -63.7 -50.6 68.55 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.425 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.6 mt -66.25 -45.57 89.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.566 -176.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.8 mtm -64.66 -40.5 95.54 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.278 -177.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.04 -41.59 47.43 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.235 179.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.63 -47.37 63.65 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.457 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 17.6 mm-40 -89.55 -2.74 58.43 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.405 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 18.8 mmmt 71.21 65.92 0.16 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 125.153 1.381 . . . . 0.0 111.288 178.825 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.457 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.9 mp -103.38 156.99 17.34 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.124 -0.944 . . . . 0.0 108.582 175.516 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -94.31 100.62 12.63 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 122.005 0.907 . . . . 0.0 109.782 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.08 -17.04 61.0 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.108 -174.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -98.2 1.73 47.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 179.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -124.3 -28.17 3.7 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.232 -0.987 . . . . 0.0 111.581 -177.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.4 p -135.68 159.65 40.98 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -108.47 157.34 18.53 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -179.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.41 HD12 ' CG1' ' A' ' 77' ' ' VAL . 23.6 tp -113.1 116.62 30.16 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.067 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.427 ' HB2' HG12 ' A' ' 80' ' ' ILE . 25.1 tt0 -116.21 115.08 25.35 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 121.806 0.812 . . . . 0.0 109.645 -176.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.4 mm -97.25 135.55 31.11 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 -174.293 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 m -121.19 141.36 50.93 Favored 'General case' 0 C--N 1.283 -2.294 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.467 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.485 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 12.4 t-20 -75.1 139.75 42.98 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.677 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.0 -28.54 39.42 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.336 0.589 . . . . 0.0 111.173 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -92.09 -49.18 6.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.425 -174.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.1 p -93.64 -19.79 20.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.982 0.42 . . . . 0.0 110.129 -174.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.2 mmmt 65.75 24.01 11.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.559 1.144 . . . . 0.0 111.139 -178.099 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -82.29 131.3 35.23 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -90.36 135.27 33.79 Favored 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 177.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -101.25 97.12 7.67 Favored 'General case' 0 C--N 1.263 -3.19 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.223 179.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -100.15 -25.39 14.3 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.985 -177.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -94.07 128.99 40.77 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -176.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.51 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -61.6 -10.74 8.9 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -91.68 -2.08 57.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.637 -178.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.29 151.14 47.35 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.586 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.16 138.94 52.59 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 118.385 0.539 . . . . 0.0 111.007 -177.642 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.48 113.98 36.45 Favored Pre-proline 0 C--N 1.315 -0.93 0 C-N-CA 119.689 -0.805 . . . . 0.0 110.445 173.027 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.7 Cg_endo -79.43 158.68 25.79 Favored 'Trans proline' 0 CA--C 1.519 -0.256 0 C-N-CA 123.128 2.552 . . . . 0.0 113.245 177.032 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -70.48 5.15 1.92 Allowed 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 121.57 0.7 . . . . 0.0 111.9 176.339 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.407 ' H ' ' C ' ' A' ' 70' ' ' PRO . 1.0 OUTLIER -87.95 -20.52 25.78 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.023 172.891 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -103.42 141.7 35.52 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -174.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -104.0 128.43 51.56 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 169.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 14.6 m -123.17 157.28 28.87 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.7 mm -103.71 125.96 58.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.41 ' CG1' HD12 ' A' ' 51' ' ' LEU . 46.4 t -100.78 114.27 39.26 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-O 121.397 0.617 . . . . 0.0 110.429 -177.515 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -113.11 138.85 49.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.887 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -100.41 128.52 46.45 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.427 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -127.85 153.61 78.09 Favored Pre-proline 0 C--N 1.312 -1.036 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 CA--C 1.537 0.668 0 C-N-CA 121.977 1.784 . . . . 0.0 111.993 179.012 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 23' ' ' THR . 36.1 m . . . . . 0 N--CA 1.409 -2.495 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.7 p -139.59 134.84 32.68 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.629 -179.034 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 21' ' ' THR . 59.6 t -107.35 135.67 45.12 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.458 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -83.92 113.32 20.89 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.195 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.636 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 29.5 p90 -129.51 136.56 50.0 Favored 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.218 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -121.79 141.01 51.64 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 173.273 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.523 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -91.66 175.87 6.74 Favored 'General case' 0 C--N 1.277 -2.566 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 177.059 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -63.43 -30.65 71.74 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 171.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.4 m -79.53 -7.04 58.2 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.682 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.523 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 3.8 mptp? -105.06 134.25 48.48 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.302 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.27 -19.47 22.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.629 0.728 . . . . 0.0 109.226 178.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 8.2 p30 -129.96 173.92 10.25 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.553 179.012 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.89 129.05 36.96 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.268 0.556 . . . . 0.0 112.179 -177.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -89.58 177.59 6.51 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.55 -1.205 . . . . 0.0 108.47 175.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -135.76 131.49 35.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.169 0.509 . . . . 0.0 110.87 -177.238 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.5 p -113.75 127.54 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.086 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 7' ' ' SER . 8.5 p -99.83 143.69 29.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.374 0.606 . . . . 0.0 112.142 -176.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -153.23 171.03 19.14 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.157 178.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.14 135.33 51.82 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.12 -115.02 2.08 Favored Glycine 0 C--N 1.302 -1.341 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tt -149.14 -41.11 0.15 Allowed 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.585 ' CG ' HD11 ' A' ' 68' ' ' LEU . 1.1 p-80 -134.81 157.25 47.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 179.521 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 tt -122.78 125.67 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.993 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.553 -179.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.1 m -58.23 141.25 51.29 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.908 173.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.9 tp -54.63 -41.23 69.78 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.918 1.287 . . . . 0.0 111.409 -177.435 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.651 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 53.7 t -54.33 -45.24 72.63 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.452 178.198 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -72.63 -43.07 63.72 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 -176.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.493 ' CD2' HD11 ' A' ' 69' ' ' ILE . 0.6 OUTLIER -67.02 -40.85 87.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.24 -174.477 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 53.1 mtmt -62.36 -38.82 91.0 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.782 -179.431 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.651 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 3.9 mptp? -61.75 -40.42 95.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.638 177.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -63.18 -51.1 67.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.783 179.435 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.6 mt -68.81 -42.83 82.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.418 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.0 -35.25 80.07 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.384 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.5 -39.16 50.87 Favored Glycine 0 C--N 1.309 -0.924 0 C-N-CA 120.308 -0.948 . . . . 0.0 111.541 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -66.77 -43.41 84.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.893 0.877 . . . . 0.0 112.549 -177.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 76.5 mm-40 -99.95 3.61 44.46 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.882 0.373 . . . . 0.0 110.993 -178.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.4 mptt 57.86 66.51 1.11 Allowed 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.387 178.11 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -98.85 154.23 18.18 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.179 177.564 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -97.69 111.62 23.83 Favored 'General case' 0 N--CA 1.401 -2.893 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.98 -1.69 26.89 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.794 -178.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.33 -12.06 18.94 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.377 -177.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.89 -37.06 6.8 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.392 0.615 . . . . 0.0 110.323 -177.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.7 m -141.43 174.36 10.62 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.441 -178.442 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -119.44 169.87 9.65 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.412 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.9 tp -114.52 122.26 46.02 Favored 'General case' 0 C--N 1.273 -2.76 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -113.55 123.34 49.76 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -177.113 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -102.94 132.11 49.8 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.84 0 C-N-CA 119.867 -0.733 . . . . 0.0 109.115 179.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.4 m -117.27 146.92 42.99 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 179.376 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.498 ' HA ' HG11 ' A' ' 75' ' ' VAL . 11.7 t-20 -74.59 138.6 43.11 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -25.77 53.43 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-O 121.211 0.529 . . . . 0.0 110.379 -178.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -92.78 -56.52 2.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.553 -176.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.5 p -90.83 -16.27 28.57 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.248 -171.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 64.03 18.44 11.22 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -174.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.18 125.89 28.08 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 175.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -89.51 125.67 35.28 Favored 'General case' 0 C--N 1.288 -2.094 0 CA-C-O 121.298 0.57 . . . . 0.0 110.676 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -92.61 100.15 12.73 Favored 'General case' 0 C--N 1.278 -2.507 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.4 p -98.2 -26.09 14.67 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.743 -175.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -95.35 135.54 36.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.19 -17.85 63.93 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.493 0.717 . . . . 0.0 110.784 -178.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -81.64 -8.75 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.727 -178.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.83 144.36 56.66 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.624 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.585 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.73 137.68 52.53 Favored 'General case' 0 C--N 1.294 -1.835 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -176.805 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.493 HD11 ' CD2' ' A' ' 34' ' ' LEU . 3.8 mp -119.69 116.48 33.16 Favored Pre-proline 0 C--N 1.302 -1.477 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.236 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 75.8 Cg_endo -80.75 160.8 21.64 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.373 2.716 . . . . 0.0 113.879 177.735 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -63.79 -8.74 11.58 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.93 175.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -81.48 -17.38 48.88 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.646 178.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 37.8 m -105.81 152.74 22.85 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.784 0.802 . . . . 0.0 111.856 -175.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 m -114.45 129.75 56.68 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 170.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.6 m -128.57 164.28 30.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 120.909 0.385 . . . . 0.0 110.917 -176.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.0 mt -122.8 129.04 75.43 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 20.3 t -100.39 132.62 45.67 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.468 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.089 -173.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -130.26 143.16 50.61 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 -176.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -97.36 134.07 41.12 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 pp -124.77 148.9 60.88 Favored Pre-proline 0 C--N 1.303 -1.429 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.934 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 N--CA 1.447 -1.254 0 C-N-CA 122.188 1.925 . . . . 0.0 111.713 178.761 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.556 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.4 m . . . . . 0 N--CA 1.405 -2.684 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.532 ' SG ' HG23 ' A' ' 23' ' ' THR . 83.8 m -138.38 133.51 33.0 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.917 -174.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.541 HG21 ' CE1' ' A' ' 24' ' ' PHE . 79.1 t -106.14 130.52 57.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.473 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 42.7 m-70 -88.63 120.17 29.78 Favored 'General case' 0 CA--C 1.482 -1.652 0 O-C-N 124.227 0.954 . . . . 0.0 109.106 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.622 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.1 p90 -132.95 139.93 47.56 Favored 'General case' 0 C--N 1.278 -2.515 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.22 148.49 43.62 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.433 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -85.97 165.45 16.72 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.957 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -66.08 -30.9 71.5 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.41 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.2 t -74.34 -57.11 4.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.87 176.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 13' ' ' PHE . 54.5 mtmt -67.4 143.22 56.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.094 0.557 . . . . 0.0 111.7 -178.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.15 -37.65 14.05 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.162 -175.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -100.76 163.23 12.42 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.528 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -87.94 152.17 22.26 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.374 0.607 . . . . 0.0 111.553 -177.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.473 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.8 t70 -121.71 176.69 5.59 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 176.449 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 4.6 p -133.33 131.17 39.81 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.504 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -95.5 117.33 39.26 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.165 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 170.157 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.532 HG23 ' SG ' ' A' ' 8' ' ' CYS . 39.9 p -86.01 121.41 28.59 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.406 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.556 ' O ' ' HB2' ' A' ' 7' ' ' SER . 16.0 p90 -143.24 161.6 37.85 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -178.106 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -101.13 132.51 46.57 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.0 -163.39 23.49 Favored Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -177.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 58.0 tp -106.97 -35.52 6.88 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 176.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.502 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -144.3 156.94 44.48 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.261 -179.242 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -126.14 131.15 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.91 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.432 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.8 m -64.98 145.54 56.2 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.131 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 47.6 tp -54.87 -46.27 74.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -172.672 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.49 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 12.7 t -58.57 -42.73 88.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 118.994 0.815 . . . . 0.0 109.87 179.412 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 6.1 m-20 -65.06 -43.51 92.0 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.132 179.193 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.29 -46.34 90.17 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.893 -179.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 52.4 mtmt -66.78 -40.57 88.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 -179.92 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.2 mptt -61.87 -34.41 75.96 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.668 178.116 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 13.3 mm100 -65.4 -50.1 66.75 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 110.102 176.115 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.3 mt -68.61 -47.13 78.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.604 -176.689 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.0 mtm -63.09 -44.3 96.11 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.17 -178.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -39.03 91.56 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.834 179.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.03 -51.51 63.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.085 0.469 . . . . 0.0 110.745 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -97.43 11.26 37.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -171.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt 67.67 38.89 2.88 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.426 1.09 . . . . 0.0 112.036 171.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.07 167.34 22.05 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.429 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -105.47 102.43 11.9 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.681 178.762 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.62 -13.7 60.04 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.52 -176.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.58 -6.85 59.12 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.871 -179.1 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -126.62 -33.08 2.57 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.511 0.672 . . . . 0.0 111.107 178.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.3 m -129.27 161.71 29.58 Favored 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.337 -175.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -118.81 171.26 8.34 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 178.171 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.2 tp -118.48 117.69 29.71 Favored 'General case' 0 N--CA 1.395 -3.193 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -174.067 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.489 ' HA ' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -101.4 123.53 45.62 Favored 'General case' 0 C--N 1.284 -2.249 0 O-C-N 120.932 -1.105 . . . . 0.0 108.408 -177.714 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.8 mm -110.23 130.67 63.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.7 m -117.13 139.48 50.68 Favored 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.371 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.509 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.8 t-20 -65.79 136.5 56.28 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 176.031 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.33 -26.18 55.51 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.254 0.549 . . . . 0.0 111.427 -177.41 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -95.69 -52.2 4.2 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.28 -176.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -90.16 -18.61 25.47 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.25 0.548 . . . . 0.0 110.223 -174.112 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 66.05 21.83 11.21 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.731 1.212 . . . . 0.0 112.153 -177.239 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -70.72 121.63 18.32 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.597 174.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -90.18 117.98 29.35 Favored 'General case' 0 N--CA 1.405 -2.723 0 CA-C-O 122.0 0.905 . . . . 0.0 110.838 -178.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -87.63 92.84 9.25 Favored 'General case' 0 C--N 1.272 -2.767 0 CA-C-N 114.101 -1.408 . . . . 0.0 107.75 -179.583 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.8 p -93.23 -17.77 23.28 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.375 -176.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -101.55 128.82 47.63 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.388 -178.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 7.8 p-10 -67.72 -7.08 24.23 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -90.79 -2.87 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.447 176.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.2 150.56 47.34 Favored 'General case' 0 C--O 1.206 -1.205 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.203 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.502 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.04 138.33 52.29 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 118.085 0.402 . . . . 0.0 110.84 -177.071 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.28 116.04 37.63 Favored Pre-proline 0 C--N 1.314 -0.956 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.563 176.11 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.0 Cg_endo -79.39 158.77 25.96 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 123.162 2.574 . . . . 0.0 113.418 176.036 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -66.67 -10.26 44.49 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.659 178.194 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -87.77 -3.88 58.92 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.386 178.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -112.59 150.88 30.76 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 121.261 0.553 . . . . 0.0 111.476 -178.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -109.73 126.7 54.0 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 13.9 m -124.57 164.77 22.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.424 0.63 . . . . 0.0 112.553 -176.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -124.3 136.07 61.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 C-N-CA 124.295 1.038 . . . . 0.0 108.728 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.17 129.28 56.69 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.612 -172.323 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -129.01 140.65 51.55 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -98.64 131.94 44.43 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.607 178.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -128.93 152.84 79.82 Favored Pre-proline 0 C--O 1.206 -1.199 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.029 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 C--N 1.318 -1.069 0 C-N-CA 122.308 2.006 . . . . 0.0 111.579 177.985 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.465 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 64.1 m . . . . . 0 N--CA 1.412 -2.357 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 27.3 p -144.25 144.48 31.53 Favored 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.49 HG22 ' CE1' ' A' ' 24' ' ' PHE . 91.2 t -105.57 132.43 52.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.331 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -82.84 104.7 13.26 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.421 ' HB2' ' CG2' ' A' ' 77' ' ' VAL . 38.2 p90 -120.71 141.23 50.62 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 -177.426 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -124.51 126.09 45.29 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 118.102 -1.439 . . . . 0.0 110.164 175.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.26 157.2 19.99 Favored 'General case' 0 C--N 1.286 -2.166 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 178.176 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.7 m -60.0 -25.06 64.97 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 120.809 0.338 . . . . 0.0 111.53 177.479 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 t -95.1 -4.75 45.69 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 121.549 0.69 . . . . 0.0 110.615 178.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.24 -43.3 11.08 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 121.712 -0.618 . . . . 0.0 110.642 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 71.89 -47.31 0.66 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.478 1.511 . . . . 0.0 111.722 -176.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -100.92 169.44 8.97 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 175.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -83.36 144.96 29.31 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.536 0.684 . . . . 0.0 112.059 -176.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -113.91 177.97 4.45 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 176.012 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.68 123.0 17.05 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.519 0.599 . . . . 0.0 110.875 -174.005 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -102.36 119.68 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 176.696 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 p -87.58 134.52 33.61 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.138 -178.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.49 ' CE1' HG22 ' A' ' 9' ' ' VAL . 34.7 p90 -144.79 176.0 9.77 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.715 -177.287 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -103.9 131.19 51.37 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.73 179.83 20.88 Favored Glycine 0 C--O 1.209 -1.407 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -83.49 -31.62 26.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.517 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -136.93 157.35 46.95 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.58 -177.862 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.06 132.48 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.783 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.573 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.457 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 6.3 m -60.83 145.49 49.72 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.408 0.683 . . . . 0.0 109.976 177.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.422 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.9 tp -57.7 -43.1 84.94 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 124.134 0.974 . . . . 0.0 112.729 -176.306 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.594 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.5 t -59.13 -45.6 90.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.635 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 14.1 m-20 -62.71 -48.77 77.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.824 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.13 -46.54 89.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.405 -176.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 39' ' ' MET . 45.6 mtmt -65.46 -44.41 87.29 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.602 -179.151 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.594 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.3 mptt -61.92 -33.45 74.28 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 116.72 -0.218 . . . . 0.0 111.263 178.251 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.635 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 24.5 mm-40 -63.76 -49.83 71.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.9 mt -67.4 -49.43 71.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.439 -177.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 93.6 mtp -61.68 -44.91 96.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.497 -175.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.72 61.54 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.305 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -72.74 -51.03 20.87 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.32 0.581 . . . . 0.0 111.628 -177.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -87.04 -9.47 55.41 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -170.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 46.8 mmtt 76.66 67.06 0.05 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 124.683 1.193 . . . . 0.0 111.654 -179.787 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -104.12 129.48 51.83 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 173.684 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.447 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 23.9 ttmm -77.67 112.7 14.76 Favored 'General case' 0 N--CA 1.408 -2.573 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.256 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -0.9 30.27 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.079 -178.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 3.24 35.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.487 0.66 . . . . 0.0 109.297 178.849 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.447 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 23.0 t70 -118.59 -51.13 2.4 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.407 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.3 m -134.05 168.04 19.54 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.064 179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -113.6 169.47 8.95 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 -179.773 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.528 HD12 ' CG1' ' A' ' 77' ' ' VAL . 26.2 tp -116.78 125.32 51.44 Favored 'General case' 0 C--N 1.271 -2.832 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.49 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -115.99 136.5 52.98 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -179.576 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 77' ' ' VAL . 39.0 mm -121.87 135.59 61.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -176.428 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.2 m -128.77 144.51 51.19 Favored 'General case' 0 C--O 1.196 -1.741 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 176.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.469 ' HA ' HG13 ' A' ' 75' ' ' VAL . 11.6 t-20 -72.95 138.43 46.11 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.737 -0.602 . . . . 0.0 109.869 179.679 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.86 -26.19 49.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.237 0.541 . . . . 0.0 111.015 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -94.69 -52.41 4.3 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.475 -176.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 p -90.88 -16.27 28.47 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.202 0.525 . . . . 0.0 110.47 -172.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 66.01 21.79 11.26 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.962 -179.522 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -83.61 130.92 34.99 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.417 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.25 143.94 33.29 Favored 'General case' 0 N--CA 1.416 -2.14 0 CA-C-O 121.024 0.44 . . . . 0.0 110.151 174.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -103.92 99.06 8.82 Favored 'General case' 0 C--N 1.273 -2.74 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.2 p -91.32 -27.24 18.52 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.804 -173.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -101.34 143.58 31.21 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.496 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.3 p-10 -74.35 -11.07 60.15 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.733 0.301 . . . . 0.0 111.785 -177.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -3.46 58.83 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.703 178.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.86 58.66 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 174.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.517 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.52 137.74 52.36 Favored 'General case' 0 C--N 1.289 -2.051 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.338 -174.685 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.27 117.37 34.91 Favored Pre-proline 0 C--N 1.306 -1.303 0 C-N-CA 119.616 -0.833 . . . . 0.0 110.551 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.427 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 55.7 Cg_endo -76.86 152.76 32.62 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.374 2.716 . . . . 0.0 113.244 175.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.465 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 42.4 pttt -57.69 -22.2 44.84 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -86.95 -1.75 58.08 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 120.961 0.41 . . . . 0.0 111.756 -177.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -106.9 147.23 30.05 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 -178.424 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.4 p -109.13 124.39 50.73 Favored 'General case' 0 N--CA 1.424 -1.727 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.469 HG13 ' HA ' ' A' ' 55' ' ' ASN . 15.9 m -123.39 149.98 27.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.569 0.7 . . . . 0.0 112.65 -177.44 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.6 mm -94.18 126.07 46.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 178.876 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.528 ' CG1' HD12 ' A' ' 51' ' ' LEU . 59.7 t -106.51 122.03 59.88 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -177.152 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -126.04 134.41 51.44 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.24 -173.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -90.27 116.78 28.5 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.419 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.49 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.77 150.52 48.54 Favored Pre-proline 0 C--N 1.308 -1.226 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.276 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--N 1.325 -0.668 0 C-N-CA 122.182 1.922 . . . . 0.0 111.876 -179.086 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 m . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.9 p -149.6 145.29 26.7 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 119.681 -0.808 . . . . 0.0 110.896 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 21' ' ' THR . 91.0 t -107.02 128.74 61.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.341 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.455 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 21.6 m-70 -77.68 105.54 8.91 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 173.89 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.546 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 33.7 p90 -123.41 140.82 52.62 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -178.305 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -117.02 137.77 52.02 Favored 'General case' 0 C--N 1.286 -2.182 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 172.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.422 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 2.2 t80 -89.9 166.69 13.35 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -178.66 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.4 t -58.94 -31.5 68.74 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.627 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 m -84.6 -7.07 59.38 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.31 -179.982 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 95.6 mttt -116.87 124.38 49.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.422 0.629 . . . . 0.0 110.67 -177.12 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -81.93 -20.57 38.4 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.651 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -114.01 164.69 13.47 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.372 -0.831 . . . . 0.0 108.8 179.852 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -83.94 148.22 27.04 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 121.87 0.843 . . . . 0.0 111.601 -179.586 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.455 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.8 t0 -120.0 178.04 4.76 Favored 'General case' 0 C--N 1.279 -2.463 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -134.85 128.52 32.85 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 118.209 0.459 . . . . 0.0 110.07 -175.536 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.3 p -106.9 122.26 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.144 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.2 p -89.41 135.31 33.66 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -177.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.446 ' CE1' HG22 ' A' ' 9' ' ' VAL . 34.1 p90 -146.73 165.61 29.12 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -176.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -95.55 111.05 23.04 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 123.953 0.783 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.74 -174.17 20.26 Favored Glycine 0 C--N 1.298 -1.539 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 tt -95.27 -26.87 15.77 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 177.434 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.422 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -143.31 151.76 40.88 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.465 178.699 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.5 tt -125.91 135.06 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.925 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.622 -177.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -62.17 141.75 58.01 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.383 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 52.1 tp -57.1 -43.22 82.03 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 123.502 0.721 . . . . 0.0 112.404 -175.616 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.522 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.4 t -56.45 -45.32 80.87 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.061 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -65.32 -42.06 93.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.376 179.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.61 -46.53 87.85 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 -179.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 44.7 mtmt -66.02 -40.43 91.07 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.248 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.522 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.89 -39.47 92.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.303 176.439 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -65.34 -50.72 64.54 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.629 177.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 75.7 mt -62.76 -48.29 88.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 123.562 0.539 . . . . 0.0 111.986 -177.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.6 mtm -64.72 -37.3 87.12 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.635 -178.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.91 64.14 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.188 -1.006 . . . . 0.0 111.36 177.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -63.51 -45.1 92.2 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.173 0.989 . . . . 0.0 111.658 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.467 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 31.7 mt-10 -103.39 3.33 35.01 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.907 -176.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.27 66.13 0.91 Allowed 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 124.614 1.166 . . . . 0.0 111.664 178.052 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.467 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.5 mp -98.69 135.09 40.69 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.597 177.553 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -77.79 108.33 10.94 Favored 'General case' 0 N--CA 1.414 -2.247 0 CA-C-O 121.45 0.643 . . . . 0.0 109.951 179.143 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.55 1.67 25.02 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.16 179.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.17 -0.88 35.23 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.65 0.738 . . . . 0.0 109.852 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -115.68 -36.33 4.25 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.001 -1.0 . . . . 0.0 108.412 179.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.58 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 17.1 p -143.32 168.68 19.23 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.962 -174.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -116.12 169.38 9.31 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 177.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.4 tp -120.32 123.01 42.08 Favored 'General case' 0 C--N 1.259 -3.342 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 -178.401 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.473 ' HB2' HG12 ' A' ' 80' ' ' ILE . 41.9 tt0 -115.54 119.21 35.4 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -175.326 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.7 mp -105.87 132.56 52.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 CA-C-O 121.407 0.622 . . . . 0.0 111.032 -176.138 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.4 m -113.94 148.63 36.5 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.344 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.543 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -75.35 141.81 43.27 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 175.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.34 -28.33 42.04 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 0.0 110.989 -178.824 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -93.89 -53.33 4.04 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.384 -175.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -84.95 -22.47 29.19 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -174.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 65.57 23.07 11.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.408 -175.833 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.47 132.18 36.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.226 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -91.15 117.11 29.35 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-O 121.505 0.669 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -86.77 93.72 9.34 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -92.42 -10.01 39.56 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.492 -177.413 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.778 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 10.5 m-20 -101.73 132.09 47.64 Favored 'General case' 0 CA--C 1.479 -1.769 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.837 176.111 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.46 0.22 30.39 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.269 0.557 . . . . 0.0 111.666 -178.786 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.778 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 9.7 p30 -90.66 1.8 56.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.797 178.337 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.31 154.47 40.94 Favored 'General case' 0 C--O 1.208 -1.091 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.422 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.45 137.39 53.2 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.68 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.42 116.68 33.44 Favored Pre-proline 0 C--N 1.302 -1.46 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.396 177.009 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -80.15 155.94 22.75 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.294 2.662 . . . . 0.0 113.75 176.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 13.6 ptmt -58.3 -21.43 49.01 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.825 178.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -87.11 -1.25 57.75 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 120.818 0.342 . . . . 0.0 111.6 -177.617 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.6 m -112.81 149.03 33.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.424 -178.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.4 p -109.39 132.49 54.08 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.9 m -132.03 160.76 42.24 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 121.405 0.621 . . . . 0.0 112.556 -177.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -108.53 125.57 65.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 179.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 43.3 t -104.86 109.72 28.51 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-O 121.517 0.675 . . . . 0.0 109.759 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -113.58 129.16 56.61 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.255 -175.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.58 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 56.5 ttp180 -91.6 129.87 37.5 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -179.213 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.473 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -130.38 153.3 81.28 Favored Pre-proline 0 C--N 1.309 -1.189 0 C-N-CA 121.116 -0.234 . . . . 0.0 110.413 -175.653 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 CA--C 1.539 0.734 0 C-N-CA 121.931 1.754 . . . . 0.0 111.122 178.103 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.783 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -63.71 114.72 2.69 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.218 1.945 . . . . 0.0 110.954 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp -71.38 123.29 21.99 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.8 -116.07 0.75 Allowed Glycine 0 N--CA 1.425 -2.089 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 m -93.02 2.0 57.01 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 121.461 0.648 . . . . 0.0 111.297 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.415 ' HA ' ' HE3' ' A' ' 6' ' ' MET . 2.0 mmt -92.73 150.72 20.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.265 0.555 . . . . 0.0 110.179 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 55.3 m -136.59 120.2 17.17 Favored 'General case' 0 N--CA 1.413 -2.32 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.543 ' SG ' HG21 ' A' ' 23' ' ' THR . 58.0 m -125.86 128.93 48.38 Favored 'General case' 0 C--N 1.291 -1.945 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.195 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.431 ' O ' ' HA ' ' A' ' 21' ' ' THR . 25.3 t -108.11 124.66 64.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.853 175.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -81.29 105.98 12.91 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.03 -0.987 . . . . 0.0 108.377 173.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.567 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.0 p90 -118.6 126.01 51.03 Favored 'General case' 0 C--N 1.278 -2.535 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.14 133.07 50.53 Favored 'General case' 0 C--N 1.278 -2.515 0 C-N-CA 118.536 -1.265 . . . . 0.0 107.688 176.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -82.93 150.52 26.39 Favored 'General case' 0 C--N 1.282 -2.333 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 p -64.43 -24.79 67.75 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.43 0.633 . . . . 0.0 110.648 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 m -80.47 -15.59 56.39 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.861 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' HB3' ' OD1' ' A' ' 18' ' ' ASN . 82.3 mttt -104.44 157.78 16.93 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.82 0.819 . . . . 0.0 112.492 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -96.74 1.24 50.68 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.054 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' A' ' 16' ' ' LYS . 30.3 p-10 -145.6 164.91 30.25 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.787 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -91.82 139.4 30.71 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.04 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.17 177.62 4.75 Favored 'General case' 0 C--N 1.279 -2.46 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -144.26 120.83 11.08 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -172.198 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.42 HG12 ' CE1' ' A' ' 11' ' ' TYR . 1.9 m -95.23 126.83 47.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.543 HG21 ' SG ' ' A' ' 8' ' ' CYS . 10.8 p -98.93 118.19 35.15 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -131.46 175.59 9.02 Favored 'General case' 0 C--N 1.281 -2.394 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.624 -178.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -107.81 150.34 27.12 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.876 0.735 . . . . 0.0 109.799 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.41 -114.74 4.2 Favored Glycine 0 N--CA 1.42 -2.398 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tt -152.58 -41.08 0.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.52 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -133.49 152.63 51.93 Favored 'General case' 0 CA--C 1.49 -1.364 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.954 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -117.9 127.34 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.574 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.97 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.4 m -63.09 140.29 58.86 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.5 tp -54.64 -39.23 67.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 124.64 1.176 . . . . 0.0 112.561 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.672 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -54.38 -46.91 73.16 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -74.93 -36.86 62.15 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.821 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.9 -47.34 85.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.721 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.7 mtmt -71.69 -44.92 63.37 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.644 -178.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.672 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.2 mptt -61.38 -35.16 76.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.273 -0.422 . . . . 0.0 112.023 -178.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.39 -49.66 62.97 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 120.481 -0.488 . . . . 0.0 109.891 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -64.97 -42.33 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.971 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.518 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 57.4 mtt -59.78 -44.89 93.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.696 0.284 . . . . 0.0 111.237 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.07 -31.01 62.25 Favored Glycine 0 C--N 1.317 -0.491 0 CA-C-O 121.664 0.591 . . . . 0.0 112.058 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.7 ttt85 -69.32 -51.28 38.65 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 123.766 0.826 . . . . 0.0 111.646 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 40.0 mm-40 -92.98 -14.23 27.73 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -172.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp 77.75 72.3 0.06 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 125.657 1.583 . . . . 0.0 111.236 -177.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.422 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.9 mp -101.0 153.85 19.19 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.089 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.538 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.96 101.88 14.23 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.666 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.02 -12.56 59.69 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.443 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.39 -15.71 57.42 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.23 177.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -117.26 -31.31 5.34 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.588 0.709 . . . . 0.0 110.606 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.0 m -129.2 165.25 21.71 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-O 122.295 1.045 . . . . 0.0 113.787 -172.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.414 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 49.5 t0 -123.08 169.66 10.97 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 173.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 35' ' ' LYS . 14.2 tp -115.34 120.09 38.48 Favored 'General case' 0 C--N 1.257 -3.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.484 ' HB2' HG12 ' A' ' 80' ' ' ILE . 7.1 tp-100 -106.49 123.45 48.1 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-O 121.267 0.556 . . . . 0.0 109.604 -176.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.8 mm -114.29 135.43 54.07 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -172.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.5 m -125.89 140.78 52.36 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 9.5 t-20 -72.55 138.22 46.76 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.28 -16.56 34.81 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.436 0.636 . . . . 0.0 110.723 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -99.17 -44.51 6.24 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.842 -173.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -100.38 -19.08 16.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.191 0.519 . . . . 0.0 110.254 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.9 mmmm 71.96 12.45 6.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.051 1.341 . . . . 0.0 112.155 -177.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.1 135.35 46.22 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.059 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -92.86 145.26 24.53 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.296 0.57 . . . . 0.0 110.544 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -105.18 98.01 7.77 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -90.56 -37.67 13.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.453 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 11.6 t70 -101.17 150.59 22.79 Favored 'General case' 0 CA--C 1.495 -1.17 0 C-N-CA 120.482 -0.487 . . . . 0.0 109.831 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -64.32 -15.21 59.87 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.453 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -83.08 -11.17 58.25 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.19 141.19 58.32 Favored 'General case' 0 C--O 1.19 -2.038 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.52 HD12 ' CG ' ' A' ' 28' ' ' HIS . 2.8 pp -117.2 137.72 52.17 Favored 'General case' 0 C--N 1.289 -2.065 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.137 -171.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.34 112.53 43.76 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 48.8 Cg_endo -78.0 156.63 30.51 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 C-N-CA 122.803 2.335 . . . . 0.0 112.865 175.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -58.24 -17.5 19.7 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.429 0.692 . . . . 0.0 112.535 178.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -82.71 -1.95 52.8 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.918 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.1 m -115.46 118.61 33.67 Favored 'General case' 0 N--CA 1.424 -1.773 0 O-C-N 122.221 -0.3 . . . . 0.0 111.371 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 m -89.8 123.21 33.58 Favored 'General case' 0 N--CA 1.425 -1.689 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.9 m -121.39 160.03 23.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 CA-C-O 120.945 0.402 . . . . 0.0 111.783 -172.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.7 mm -107.5 133.97 50.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.44 117.75 52.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.444 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -114.46 137.28 52.04 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -92.74 124.64 36.89 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.548 -0.72 . . . . 0.0 109.666 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.484 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -125.89 149.34 65.66 Favored Pre-proline 0 C--O 1.206 -1.202 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.144 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.79 141.06 33.16 Favored 'Trans proline' 0 C--N 1.32 -0.963 0 C-N-CA 122.297 1.998 . . . . 0.0 111.827 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.443 HG13 ' H ' ' A' ' 83' ' ' GLY . 3.9 pt -69.69 -68.13 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.443 ' H ' HG13 ' A' ' 82' ' ' ILE . . . -168.89 55.73 0.21 Allowed Glycine 0 CA--C 1.49 -1.485 0 C-N-CA 120.023 -1.084 . . . . 0.0 111.411 -178.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.42 -79.46 0.07 OUTLIER Glycine 0 CA--C 1.468 -2.892 0 N-CA-C 107.528 -2.229 . . . . 0.0 107.528 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.4 m -77.7 140.49 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 170.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt . . . . . 0 C--N 1.281 -2.38 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.664 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.63 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -93.95 -157.01 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.349 0 C-N-CA 122.97 2.447 . . . . 0.0 107.942 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.55 101.83 0.65 Allowed 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.35 106.88 3.43 Favored Glycine 0 N--CA 1.416 -2.691 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -177.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.0 t -90.43 14.69 12.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.8 ptp -56.95 157.54 5.63 Favored 'General case' 0 CA--C 1.498 -1.056 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.279 176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 73.4 m -127.09 123.32 36.61 Favored 'General case' 0 N--CA 1.392 -3.372 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.899 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.1 p -139.04 135.66 34.46 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.385 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.566 HG22 ' CE1' ' A' ' 24' ' ' PHE . 69.1 t -105.19 129.57 57.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -82.97 115.76 21.95 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.91 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.572 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 51.0 p90 -133.66 142.01 47.85 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -120.25 136.99 54.47 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 118.331 -1.348 . . . . 0.0 108.124 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -83.96 174.63 10.18 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -56.55 -37.31 70.35 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.157 0.583 . . . . 0.0 112.482 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.3 m -90.96 1.68 56.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.185 0.517 . . . . 0.0 111.498 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.411 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 1.4 mptm? -98.13 127.32 44.0 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.496 0.665 . . . . 0.0 111.615 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.8 tp -91.4 -21.65 20.87 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.964 -1.016 . . . . 0.0 108.341 175.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.22 149.11 46.76 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.011 -1.449 . . . . 0.0 108.954 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -78.16 147.2 34.64 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.411 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 28.4 m-20 -101.11 173.87 6.26 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.9 p -136.15 132.35 35.9 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -102.33 126.15 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 169.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.9 p -94.51 129.54 41.26 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.566 ' CE1' HG22 ' A' ' 9' ' ' VAL . 32.3 p90 -145.99 158.68 43.87 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -95.35 132.9 39.88 Favored 'General case' 0 C--N 1.296 -1.752 0 C-N-CA 119.994 -0.683 . . . . 0.0 111.072 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.92 -146.93 17.39 Favored Glycine 0 N--CA 1.437 -1.297 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.37 -41.95 2.58 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.498 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -131.53 152.74 50.49 Favored 'General case' 0 CA--C 1.479 -1.764 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.264 177.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.52 ' HB ' ' CD2' ' A' ' 24' ' ' PHE . 12.4 tt -119.34 126.09 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.732 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.262 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.1 m -55.54 142.31 33.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.445 ' HG ' ' HE2' ' A' ' 35' ' ' LYS . 60.0 tp -58.36 -38.08 76.5 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.749 0.82 . . . . 0.0 112.309 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.676 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 35.6 t -56.18 -46.92 79.18 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 30.3 t70 -69.91 -37.89 76.11 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.291 -174.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.07 -46.53 67.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.781 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.9 mtmt -66.03 -40.06 90.72 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.357 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.676 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -64.02 -35.2 79.93 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 123.552 0.532 . . . . 0.0 111.163 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 94.6 mt-30 -65.0 -47.21 78.33 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.65 -44.73 93.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.258 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.498 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 54.5 mtt -60.12 -43.83 95.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.673 0.273 . . . . 0.0 110.465 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -33.12 73.22 Favored Glycine 0 C--N 1.317 -0.525 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.54 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -70.97 -51.25 26.77 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.988 0.423 . . . . 0.0 111.186 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -84.57 -6.59 59.38 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.427 -172.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 7.6 mmmm 67.03 46.97 1.45 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.6 tp -83.3 115.61 22.06 Favored 'General case' 0 N--CA 1.411 -2.406 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.095 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.562 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.49 109.9 8.35 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-O 121.711 0.767 . . . . 0.0 110.289 177.432 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.31 58.16 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.787 -174.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.91 -1.71 57.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.556 0.694 . . . . 0.0 110.125 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -108.99 -51.65 2.86 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.794 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.7 m -140.01 164.62 29.53 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.446 0.641 . . . . 0.0 111.91 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.485 ' HB2' ' HA ' ' A' ' 82' ' ' ILE . 7.4 t70 -108.61 170.57 7.94 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.433 HD12 ' CG1' ' A' ' 77' ' ' VAL . 17.5 tp -118.58 112.5 19.95 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-O 121.334 0.588 . . . . 0.0 109.847 -172.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.404 ' HB2' HG12 ' A' ' 80' ' ' ILE . 19.0 tt0 -101.91 125.67 48.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.431 ' CG1' HD13 ' A' ' 31' ' ' LEU . 44.4 mm -113.21 132.7 61.32 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -126.39 141.24 51.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 122.338 -0.226 . . . . 0.0 110.43 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.428 ' HA ' HG13 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -59.52 124.24 19.43 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 122.856 0.462 . . . . 0.0 110.79 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.88 -28.91 64.89 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.79 -48.21 7.4 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.474 -0.785 . . . . 0.0 112.898 -175.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.9 p -103.83 -8.04 20.07 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.292 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 59.3 25.13 13.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.71 126.17 30.6 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -91.25 137.71 32.15 Favored 'General case' 0 C--N 1.287 -2.109 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.401 ' CD1' ' HB2' ' A' ' 67' ' ' ALA . 72.7 m-85 -103.9 106.61 17.17 Favored 'General case' 0 C--N 1.278 -2.503 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.0 p -101.94 -17.9 15.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.021 -175.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.487 ' HB3' HD21 ' A' ' 66' ' ' ASN . 5.2 t70 -106.18 139.78 40.16 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.201 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -62.75 -16.48 57.93 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 122.886 0.474 . . . . 0.0 111.969 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.487 HD21 ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -77.37 -10.36 59.4 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.472 0.309 . . . . 0.0 111.479 -178.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' A' ' 62' ' ' TYR . . . -69.21 150.22 47.71 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.514 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.498 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -118.86 138.29 52.84 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 118.655 0.661 . . . . 0.0 111.225 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -121.19 117.17 30.73 Favored Pre-proline 0 C--N 1.316 -0.86 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.507 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 58.7 Cg_endo -76.67 154.89 35.13 Favored 'Trans proline' 0 C--N 1.332 -0.293 0 C-N-CA 123.148 2.565 . . . . 0.0 113.66 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.406 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.45 -8.61 55.94 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 122.092 0.949 . . . . 0.0 111.263 178.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -85.18 -1.67 57.16 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.527 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.8 m -119.81 174.58 6.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-O 121.427 0.632 . . . . 0.0 110.947 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.3 m -138.03 139.95 39.86 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.572 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 4.5 m -132.56 161.61 41.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 35.3 mm -106.36 131.84 55.06 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.433 ' CG1' HD12 ' A' ' 51' ' ' LEU . 49.7 t -105.06 117.22 50.34 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.198 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -119.71 121.27 38.84 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 121.569 0.7 . . . . 0.0 110.849 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -81.68 118.64 22.99 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.211 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.59 154.03 66.42 Favored Pre-proline 0 C--O 1.211 -0.946 0 N-CA-C 110.359 -0.237 . . . . 0.0 110.359 -176.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 129.71 28.69 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 C-N-CA 122.364 2.043 . . . . 0.0 111.733 178.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.485 ' HA ' ' HB2' ' A' ' 50' ' ' ASP . 2.8 pt -44.05 -39.24 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -133.49 20.33 4.17 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 119.365 -1.397 . . . . 0.0 112.885 178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.4 -61.84 4.66 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -176.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.9 t -86.26 117.07 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.161 0 N-CA-C 105.685 -1.968 . . . . 0.0 105.685 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt . . . . . 0 C--N 1.286 -2.178 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.917 177.493 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.613 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -66.28 110.11 1.71 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.24 1.96 . . . . 0.0 111.109 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.3 mt -85.09 100.94 12.04 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 147.79 110.21 0.58 Allowed Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.0 t -74.37 -28.27 61.04 Favored 'General case' 0 C--O 1.249 1.05 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 24.9 ptm -71.67 108.67 5.13 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.792 -1.549 . . . . 0.0 108.239 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.558 ' O ' ' HA ' ' A' ' 23' ' ' THR . 50.9 m -107.63 150.77 26.5 Favored 'General case' 0 C--N 1.253 -3.591 0 CA-C-N 113.64 -1.618 . . . . 0.0 108.104 -173.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.6 p -140.43 136.82 33.44 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.093 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.542 HG22 ' CE1' ' A' ' 24' ' ' PHE . 68.9 t -105.84 128.48 60.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -78.32 113.96 16.79 Favored 'General case' 0 CA--C 1.484 -1.558 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.583 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.3 p90 -135.08 138.38 43.77 Favored 'General case' 0 C--N 1.277 -2.545 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -125.04 136.59 53.83 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 118.615 -1.234 . . . . 0.0 109.788 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -88.59 170.67 10.65 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 179.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.8 p -66.13 -15.68 63.32 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.303 0.573 . . . . 0.0 112.051 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.5 p -94.57 -11.85 28.65 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 123.215 0.606 . . . . 0.0 111.763 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 0.9 OUTLIER -102.73 133.25 48.09 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 120.9 0.381 . . . . 0.0 110.732 -175.171 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.19 -22.82 22.6 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -127.37 170.82 12.11 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -82.37 133.57 35.23 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.541 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 20.2 m-20 -83.98 175.88 9.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 171.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.09 116.07 8.84 Favored 'General case' 0 C--N 1.292 -1.912 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.146 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.584 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -95.21 125.85 47.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.558 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.1 p -93.9 123.88 37.54 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-O 121.592 0.711 . . . . 0.0 112.783 -177.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.542 ' CE1' HG22 ' A' ' 9' ' ' VAL . 22.7 p90 -136.35 176.14 8.96 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -178.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.2 148.7 30.51 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.37 -113.15 3.6 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.785 176.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -148.5 -41.32 0.16 Allowed 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -137.33 155.36 49.51 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.95 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.5 tt -126.56 131.77 70.94 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.593 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.238 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 m -63.52 140.28 58.86 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.4 tp -55.65 -36.68 67.32 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.566 1.146 . . . . 0.0 112.443 -176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.722 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 18.7 t -54.13 -46.86 72.29 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 13.9 t70 -74.38 -37.82 63.33 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -175.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.39 -46.97 85.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.684 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -70.06 -39.88 75.4 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.983 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -65.11 -37.08 86.33 Favored 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.515 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.583 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 89.2 mt-30 -66.36 -45.37 80.39 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.09 -41.06 81.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.911 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.5 mtm -63.95 -37.27 86.79 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.425 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.52 -44.17 41.96 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 120.283 -0.96 . . . . 0.0 111.747 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 25.5 ttt180 -64.84 -49.41 70.68 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' OE2' ' HG2' ' A' ' 41' ' ' ARG . 23.1 mm-40 -92.65 12.99 21.34 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.669 0.271 . . . . 0.0 111.72 -173.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 57.34 47.44 16.64 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.292 1.037 . . . . 0.0 112.166 176.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 mp -81.81 160.89 23.42 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.975 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -96.96 112.43 24.19 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.62 -13.38 58.03 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.06 -13.71 22.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.727 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.455 ' O ' HG12 ' A' ' 82' ' ' ILE . 14.5 t70 -113.84 -38.52 4.22 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 121.768 0.794 . . . . 0.0 110.73 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.01 174.63 7.47 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.66 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.514 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 23.5 t0 -126.43 166.41 17.25 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 178.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.474 ' HG ' HD12 ' A' ' 53' ' ' ILE . 28.5 tp -121.85 113.72 20.04 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -111.59 123.61 50.59 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.976 -175.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.474 HD12 ' HG ' ' A' ' 51' ' ' LEU . 2.0 mp -113.41 127.36 70.76 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -173.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.428 ' OG1' ' HG2' ' A' ' 61' ' ' GLU . 29.8 m -122.22 134.57 54.7 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.509 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -62.71 140.16 58.71 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -21.37 41.42 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.232 0.539 . . . . 0.0 111.68 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -101.14 -48.27 4.47 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.712 -176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.5 p -90.74 -20.04 22.86 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.355 0.597 . . . . 0.0 109.855 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.3 mmmt 64.14 24.1 13.35 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.585 1.154 . . . . 0.0 110.928 -177.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -80.52 125.01 29.43 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' HG2' ' OG1' ' A' ' 54' ' ' THR . 44.0 mt-10 -86.12 125.72 33.68 Favored 'General case' 0 N--CA 1.402 -2.839 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.78 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.48 94.74 9.99 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.014 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -88.7 -27.35 21.29 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.954 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.41 ' HB3' HD21 ' A' ' 66' ' ' ASN . 6.1 t70 -102.99 146.9 27.65 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.691 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.528 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -69.15 -14.33 62.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.41 HD21 ' HB3' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -81.6 -10.88 59.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.102 -179.45 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.81 143.31 57.95 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.422 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.65 137.55 52.57 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 118.705 0.684 . . . . 0.0 110.762 -175.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.29 118.74 35.41 Favored Pre-proline 0 C--N 1.314 -0.958 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.006 176.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 80.4 Cg_endo -82.64 161.03 16.7 Favored 'Trans proline' 0 C--N 1.326 -0.651 0 C-N-CA 123.478 2.785 . . . . 0.0 113.66 176.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.481 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 40.2 pttt -70.05 -5.84 29.46 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.737 0.779 . . . . 0.0 111.203 175.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -87.65 -1.49 57.99 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.045 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -124.42 152.91 42.7 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.971 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.9 m -116.23 133.62 55.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.3 m -127.78 156.13 39.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.506 0.67 . . . . 0.0 112.406 -174.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -101.15 128.67 53.18 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 106.622 -1.621 . . . . 0.0 106.622 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.411 ' CG1' HD12 ' A' ' 51' ' ' LEU . 46.9 t -108.77 115.29 49.03 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -116.52 126.7 53.71 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.46 -174.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -89.82 111.53 22.58 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 pp -111.01 149.99 41.26 Favored Pre-proline 0 C--N 1.297 -1.711 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.8 138.56 13.37 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.724 1.616 . . . . 0.0 112.893 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.514 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 38.1 pt -81.81 -25.45 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 172.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 165.88 -71.78 0.18 Allowed Glycine 0 N--CA 1.408 -3.231 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 177.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.67 174.06 32.12 Favored Glycine 0 N--CA 1.421 -2.347 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.9 m -62.65 126.77 21.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-O 121.523 0.678 . . . . 0.0 112.038 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--N 1.3 -1.555 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 178.533 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.985 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -64.08 -31.81 64.85 Favored 'Trans proline' 0 C--O 1.239 0.551 0 C-N-CA 122.825 2.35 . . . . 0.0 112.298 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.33 162.5 13.14 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 96.0 147.79 23.18 Favored Glycine 0 N--CA 1.419 -2.436 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.434 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.9 m -89.38 102.21 14.89 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 87.5 mtp -99.57 -171.05 1.99 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.045 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 38.6 m -117.03 112.53 21.07 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 64.3 m -139.5 135.45 33.51 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.389 -174.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 21' ' ' THR . 77.5 t -106.82 132.07 55.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -88.1 115.21 25.42 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.596 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 46.0 p90 -130.02 130.9 45.55 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 pttp -109.32 139.22 44.55 Favored 'General case' 0 C--N 1.3 -1.577 0 C-N-CA 116.733 -1.987 . . . . 0.0 107.355 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -84.01 165.9 18.21 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.7 m -69.77 -16.99 63.4 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.325 0.583 . . . . 0.0 110.925 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 p -90.59 -13.06 35.2 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 121.367 0.603 . . . . 0.0 110.274 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -105.45 147.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.447 0.642 . . . . 0.0 111.31 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.7 mp -96.89 -30.79 12.93 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -105.89 163.22 12.91 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.394 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -86.89 142.97 27.64 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.363 0.601 . . . . 0.0 111.789 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -108.53 177.37 4.81 Favored 'General case' 0 C--N 1.288 -2.104 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -143.67 128.05 17.86 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -174.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 1.9 m -95.79 128.61 46.83 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 172.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.416 HG21 ' SG ' ' A' ' 8' ' ' CYS . 21.8 p -94.96 122.41 37.58 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.581 ' O ' ' HB2' ' A' ' 7' ' ' SER . 21.0 p90 -140.49 171.31 14.32 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -177.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -114.06 122.24 46.27 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.51 -172.32 23.07 Favored Glycine 0 N--CA 1.43 -1.709 0 N-CA-C 108.979 -1.648 . . . . 0.0 108.979 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -96.44 -33.52 11.85 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.173 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.513 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -146.06 151.52 37.86 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.119 -177.515 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -120.29 129.49 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.413 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.968 -178.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -60.96 142.22 56.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.971 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.416 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.3 tp -55.23 -40.58 71.03 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 124.734 1.214 . . . . 0.0 111.389 -177.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.598 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 36.0 t -54.14 -46.44 72.23 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.528 0.518 . . . . 0.0 109.808 178.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.1 t70 -74.9 -41.05 60.48 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.861 -176.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -60.53 -44.18 96.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.175 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 51.0 mtmt -65.37 -38.62 90.6 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.436 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.598 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 6.0 mptp? -61.63 -37.93 85.78 Favored 'General case' 0 C--O 1.243 0.75 0 O-C-N 123.012 0.195 . . . . 0.0 110.859 177.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 67.6 mm-40 -67.22 -50.39 60.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.14 -43.76 84.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.133 -176.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.9 mtm -63.97 -39.51 94.3 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 122.273 -0.267 . . . . 0.0 111.047 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -42.28 74.23 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.386 177.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.61 -46.46 75.79 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 52.2 mm-40 -92.07 2.34 56.63 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt 65.33 53.55 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 124.946 1.298 . . . . 0.0 111.051 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 8.7 mp -88.81 158.26 18.2 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.203 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -93.91 100.78 12.88 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-O 122.153 0.978 . . . . 0.0 109.172 175.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.31 60.33 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.991 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.42 -12.25 32.69 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.043 0.449 . . . . 0.0 111.447 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -105.45 -39.76 6.03 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.203 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.11 177.14 7.52 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.733 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -127.51 171.17 11.84 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.411 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 18.2 tp -118.41 125.46 50.02 Favored 'General case' 0 C--N 1.275 -2.667 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.498 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.8 tt0 -114.02 121.94 45.39 Favored 'General case' 0 C--N 1.29 -2.0 0 O-C-N 121.831 -0.543 . . . . 0.0 110.216 -175.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.0 mp -114.08 127.64 71.4 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.977 0 CA-C-O 120.969 0.414 . . . . 0.0 110.809 -175.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.9 m -111.21 144.61 40.09 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.487 ' HA ' HG11 ' A' ' 75' ' ' VAL . 11.0 t-20 -80.85 131.39 35.38 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.55 -11.07 58.7 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 120.963 0.411 . . . . 0.0 111.456 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -105.92 -47.92 3.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.006 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.6 p -89.68 -19.19 25.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt 71.85 14.55 5.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.456 1.502 . . . . 0.0 110.678 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -80.68 131.33 35.45 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -95.11 126.75 40.66 Favored 'General case' 0 N--CA 1.408 -2.53 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.491 ' CD1' ' HB2' ' A' ' 67' ' ' ALA . 32.6 m-85 -90.51 101.93 14.66 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -177.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.9 p -101.01 -22.22 14.81 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.161 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.03 147.61 26.74 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.504 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -76.32 -7.83 55.79 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.74 -10.91 58.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.491 ' HB2' ' CD1' ' A' ' 62' ' ' TYR . . . -62.2 141.46 58.18 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.12 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.513 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -117.53 138.42 51.91 Favored 'General case' 0 C--N 1.29 -2.018 0 O-C-N 121.908 -0.495 . . . . 0.0 111.437 -174.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.27 115.69 42.44 Favored Pre-proline 0 C--N 1.309 -1.162 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.441 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.476 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 54.7 Cg_endo -80.25 153.43 21.41 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.988 2.458 . . . . 0.0 113.592 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 16.1 ptmt -60.35 -20.27 58.79 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.852 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -75.31 -19.56 59.57 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.164 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.415 ' OG ' ' HG2' ' A' ' 70' ' ' PRO . 24.7 m -104.32 139.39 39.37 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-O 121.588 0.709 . . . . 0.0 112.455 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.3 m -97.89 129.38 44.83 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 171.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -123.95 164.39 22.11 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.5 mt -120.93 130.15 74.95 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.1 t -102.27 124.39 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.772 -173.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -120.33 145.03 47.52 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.0 ttm105 -100.68 125.85 47.15 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.498 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -129.49 156.29 78.83 Favored Pre-proline 0 C--O 1.217 -0.639 0 C-N-CA 121.249 -0.18 . . . . 0.0 110.83 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -75.97 140.65 23.11 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.079 1.852 . . . . 0.0 110.318 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 17.6 pt -65.48 -45.6 92.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.964 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 52.92 44.02 61.45 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.697 -178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.36 139.33 6.13 Favored Glycine 0 N--CA 1.426 -1.972 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.5 m -99.71 104.46 16.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 CA-C-O 122.183 0.992 . . . . 0.0 110.954 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.6 pttp . . . . . 0 C--N 1.291 -1.966 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.011 -178.775 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.312 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.28 -170.46 0.8 Allowed 'Trans proline' 0 C--O 1.246 0.894 0 C-N-CA 122.383 2.055 . . . . 0.0 110.407 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.3 tp -56.85 123.96 16.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 113.56 50.38 0.53 Allowed Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 108.458 -1.857 . . . . 0.0 108.458 -171.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.2 m -109.15 14.94 23.62 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp 64.25 -170.87 0.18 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.028 -1.442 . . . . 0.0 110.393 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.562 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.6 m -132.32 122.25 24.81 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.5 p -148.43 143.33 26.7 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.834 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.434 HG22 ' CE1' ' A' ' 24' ' ' PHE . 98.6 t -106.26 131.94 54.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -77.56 112.32 14.22 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 124.056 0.848 . . . . 0.0 108.749 174.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.625 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -132.31 141.47 48.98 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -120.54 142.46 49.31 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 117.77 -1.572 . . . . 0.0 108.473 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.535 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -84.5 157.38 21.32 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 176.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -55.58 -31.0 61.82 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.254 0.622 . . . . 0.0 112.601 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -122.43 16.63 10.51 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.123 0.487 . . . . 0.0 111.106 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 16.1 tptm -86.13 -29.03 23.61 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.6 tp 74.04 -52.78 0.69 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.102 1.761 . . . . 0.0 112.174 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -98.75 152.61 19.49 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.081 -178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -74.95 142.86 43.9 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.915 0.864 . . . . 0.0 112.274 -178.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -115.24 178.74 4.18 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -140.4 117.36 11.11 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 120.866 0.365 . . . . 0.0 110.289 -174.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.564 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 13.0 p -95.37 118.7 42.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.4 p -85.66 127.33 34.46 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.974 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' A' ' 7' ' ' SER . 32.9 p90 -142.35 176.29 9.11 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -114.68 144.67 43.06 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.26 -179.14 19.8 Favored Glycine 0 C--N 1.306 -1.137 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -175.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -87.22 -33.36 19.35 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 118.03 0.915 . . . . 0.0 109.068 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.516 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -138.1 159.88 40.87 Favored 'General case' 0 CA--C 1.484 -1.576 0 CA-C-N 114.746 -1.116 . . . . 0.0 112.119 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.2 tt -128.28 128.53 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.098 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.536 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.6 m -62.66 147.03 50.65 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.256 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.73 -42.19 88.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 123.972 0.909 . . . . 0.0 112.697 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.581 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 33.7 t -56.5 -45.55 80.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.46 -45.78 82.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.909 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.36 -46.57 82.85 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.912 -176.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' HD21 ' A' ' 51' ' ' LEU . 52.8 mtmt -64.17 -41.18 97.24 Favored 'General case' 0 C--O 1.207 -1.139 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.581 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -62.94 -37.24 86.25 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -62.59 -50.62 70.54 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.025 0.441 . . . . 0.0 109.831 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.77 -47.8 68.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.87 -176.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.6 mtm -65.8 -33.59 76.21 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.43 35.71 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 119.211 -1.471 . . . . 0.0 111.16 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -59.63 -50.86 72.22 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.521 0.728 . . . . 0.0 111.931 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 7.7 mm-40 -92.72 0.22 57.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.266 0.555 . . . . 0.0 110.338 -174.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 60.75 70.93 0.59 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.69 1.196 . . . . 0.0 112.686 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.464 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.3 mp -103.97 144.2 31.84 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.526 -1.216 . . . . 0.0 108.899 175.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -92.9 103.49 15.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.972 0.892 . . . . 0.0 111.331 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.95 -16.48 62.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.43 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.04 1.75 51.88 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.308 0.575 . . . . 0.0 110.994 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 82' ' ' ILE . 26.0 t70 -122.16 -36.72 2.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.608 0.718 . . . . 0.0 109.955 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -135.44 153.61 51.72 Favored 'General case' 0 N--CA 1.42 -1.951 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.717 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.492 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 27.0 t0 -108.6 159.92 16.34 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.44 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.6 tp -107.68 107.95 18.98 Favored 'General case' 0 C--N 1.267 -2.989 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.443 ' HB2' HG12 ' A' ' 80' ' ' ILE . 31.8 tt0 -103.43 108.96 20.42 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.908 0.861 . . . . 0.0 109.123 -173.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.427 HD11 HG21 ' A' ' 77' ' ' VAL . 25.3 mm -94.56 135.42 28.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.314 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.3 m -118.8 149.33 41.69 Favored 'General case' 0 C--N 1.281 -2.4 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.7 t-20 -72.49 139.69 47.79 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.45 -26.25 51.3 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.144 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -92.74 -58.15 2.44 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.449 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.9 p -87.94 -16.61 33.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.152 0.501 . . . . 0.0 110.67 -171.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 63.71 21.79 12.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.091 0.956 . . . . 0.0 111.489 -177.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -75.46 130.4 38.86 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -87.44 137.49 32.29 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-O 121.097 0.475 . . . . 0.0 110.665 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -103.77 103.0 12.84 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -106.39 -19.96 13.53 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.922 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -90.21 133.62 34.8 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.425 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.5 m-20 -66.96 -13.25 61.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 120.801 0.334 . . . . 0.0 111.881 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -85.43 -6.19 59.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.32 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.28 141.77 58.64 Favored 'General case' 0 C--O 1.208 -1.117 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.516 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.96 137.63 52.71 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -177.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.72 115.45 35.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.278 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -77.71 155.85 31.28 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.042 2.495 . . . . 0.0 113.254 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 53.5 pttt -69.71 -8.14 45.3 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.536 0.684 . . . . 0.0 111.447 178.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -81.56 -17.7 47.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.383 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.5 m -105.71 158.72 16.52 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.879 -177.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 m -119.62 136.86 54.21 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.625 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -130.9 166.24 29.09 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 CA-C-O 121.078 0.466 . . . . 0.0 111.102 -175.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.5 mt -120.03 130.57 74.11 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.427 HG21 HD11 ' A' ' 53' ' ' ILE . 57.6 t -102.01 122.47 54.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.005 -173.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -127.51 128.13 45.16 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 47.6 ttp180 -88.1 125.85 34.8 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.443 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -122.68 142.18 36.98 Favored Pre-proline 0 N--CA 1.439 -0.988 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -75.13 128.53 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.481 0 C-N-CA 122.261 1.974 . . . . 0.0 110.847 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.492 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.9 pt -72.1 -30.73 37.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.541 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.62 -20.73 61.21 Favored Glycine 0 N--CA 1.441 -1.02 0 C-N-CA 120.209 -0.996 . . . . 0.0 111.193 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.81 -55.29 3.19 Favored Glycine 0 N--CA 1.434 -1.461 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 48.1 t -94.19 95.52 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 mttp . . . . . 0 C--N 1.3 -1.555 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.199 -178.178 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.276 0 CA-C-O 119.163 -0.798 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.35 -50.39 12.17 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 123.614 2.876 . . . . 0.0 112.609 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.96 -47.39 9.01 Favored 'General case' 0 CA--C 1.485 -1.521 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.0 -100.47 0.22 Allowed Glycine 0 N--CA 1.398 -3.875 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.374 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 m 58.39 35.64 24.92 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 -174.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -62.98 154.04 31.81 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.183 -1.826 . . . . 0.0 113.035 -171.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.8 m -127.4 134.25 49.92 Favored 'General case' 0 N--CA 1.403 -2.795 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.909 -177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 14.5 p -146.37 140.19 26.18 Favored 'General case' 0 N--CA 1.418 -2.043 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.513 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.9 t -107.74 124.66 63.98 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.256 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -73.62 105.35 4.91 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 124.203 0.939 . . . . 0.0 108.893 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.627 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -124.97 133.39 53.03 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -108.31 134.73 50.73 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 117.205 -1.798 . . . . 0.0 108.283 174.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.407 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 1.2 t80 -97.88 161.79 13.56 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.161 -2.162 . . . . 0.0 105.161 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 t -59.71 -26.29 65.5 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 t -87.86 -12.0 46.12 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.175 0.512 . . . . 0.0 110.833 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 2.8 mptp? -96.18 133.09 40.91 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 177.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.68 -22.76 25.89 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.3 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 18.7 m120 -120.42 168.62 11.12 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.572 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -76.5 144.67 39.64 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.644 0.735 . . . . 0.0 112.122 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -104.85 177.88 4.72 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.2 p -141.77 113.68 7.96 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 118.716 0.689 . . . . 0.0 112.006 -174.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.16 136.61 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.9 p -108.24 145.47 34.26 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -174.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.1 p90 -158.71 157.36 31.63 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.12 115.35 28.84 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 118.224 0.465 . . . . 0.0 109.78 175.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.23 175.6 14.97 Favored Glycine 0 C--N 1.284 -2.345 0 N-CA-C 108.205 -1.958 . . . . 0.0 108.205 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.0 tp -85.43 -32.86 22.1 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 118.409 1.105 . . . . 0.0 110.774 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.428 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -145.5 151.24 37.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -177.247 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.9 131.37 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.039 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.622 -177.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.1 m -61.84 148.05 44.55 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 123.122 0.569 . . . . 0.0 110.376 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 124.059 0.944 . . . . 0.0 111.394 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.618 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 49.5 t -55.59 -46.13 77.32 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -69.71 -44.33 70.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.261 0.553 . . . . 0.0 110.289 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.43 -45.82 89.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.09 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.527 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.0 mtmt -62.7 -42.96 99.91 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.922 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.618 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.3 mptp? -61.47 -35.44 77.64 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 120.753 0.311 . . . . 0.0 111.123 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -69.85 -42.71 73.19 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.457 ' O ' ' HB3' ' A' ' 41' ' ' ARG . 66.3 mt -74.34 -36.21 41.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.691 0.281 . . . . 0.0 111.444 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.5 mtt -62.45 -46.0 90.49 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.83 -38.67 93.16 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.258 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 25.8 tpt180 -54.62 -50.24 68.57 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.552 1.541 . . . . 0.0 110.925 178.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.41 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 67.1 mm-40 -100.58 6.29 44.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -176.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.415 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 63.96 36.23 10.21 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.591 0.756 . . . . 0.0 111.999 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.41 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.3 mp -66.74 154.05 41.72 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.599 0.714 . . . . 0.0 112.382 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.436 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 19.9 ptmt -98.44 106.88 19.22 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.652 173.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.83 -6.06 55.06 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.231 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.96 -5.5 59.23 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.904 177.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.501 ' O ' HG12 ' A' ' 82' ' ' ILE . 17.9 t70 -128.88 -42.36 1.41 Allowed 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.511 0.672 . . . . 0.0 109.756 176.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.5 m -120.62 157.58 29.23 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -113.46 169.34 9.03 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.7 tp -119.62 113.41 20.65 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 119.756 -0.778 . . . . 0.0 108.953 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HB2' HG12 ' A' ' 80' ' ' ILE . 9.3 tt0 -106.53 120.5 42.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.049 -177.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.1 mm -106.5 135.68 43.96 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.7 -171.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 23.4 m -117.28 151.06 37.73 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 175.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -78.03 145.71 35.75 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 175.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.29 -21.86 24.2 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.304 0.573 . . . . 0.0 110.861 -178.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -96.75 -48.87 5.31 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.579 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 35.9 p -93.77 -21.89 19.03 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.02 0.438 . . . . 0.0 110.353 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 68.3 19.36 9.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.037 1.335 . . . . 0.0 112.139 -175.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.51 125.8 27.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.9 mt-10 -87.73 127.48 35.31 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.224 0.535 . . . . 0.0 110.785 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -93.04 100.95 13.28 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.0 p -99.19 -35.86 9.85 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.646 -176.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -85.88 135.71 33.59 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -66.8 -12.45 58.96 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -90.91 -1.42 57.84 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.867 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.92 148.29 51.77 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.428 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.62 137.63 53.14 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 118.393 0.542 . . . . 0.0 110.689 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -115.87 118.45 38.58 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.968 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.431 ' C ' ' H ' ' A' ' 72' ' ' ASN . 83.3 Cg_endo -83.62 157.5 14.18 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.097 2.532 . . . . 0.0 112.982 176.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.74 3.26 5.3 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 122.495 1.141 . . . . 0.0 110.78 176.462 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 70' ' ' PRO . 15.2 m120 -87.68 -18.55 29.28 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.05 176.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.7 m -116.31 151.59 35.56 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.355 0.598 . . . . 0.0 111.74 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.2 t -105.96 137.63 43.53 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 176.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -128.46 159.65 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-O 121.648 0.737 . . . . 0.0 112.781 -177.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.3 mm -109.42 126.29 66.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.4 123.26 54.38 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.283 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 ttp-105 -122.94 124.48 43.29 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.225 0.536 . . . . 0.0 109.856 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -83.59 120.33 25.83 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.495 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -124.66 153.84 70.06 Favored Pre-proline 0 C--O 1.201 -1.471 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -178.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.86 138.76 38.25 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.07 1.847 . . . . 0.0 111.947 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ASP . 11.3 pt -68.12 -31.73 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-O 121.558 0.694 . . . . 0.0 110.478 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 143.7 29.6 0.11 Allowed Glycine 0 N--CA 1.428 -1.835 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.404 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.78 165.12 13.83 Favored Glycine 0 N--CA 1.426 -1.985 0 N-CA-C 108.968 -1.653 . . . . 0.0 108.968 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.8 p -76.57 113.1 15.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 CA-C-O 121.855 0.836 . . . . 0.0 109.505 178.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.2 mttm . . . . . 0 C--N 1.297 -1.685 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.854 -176.913 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.359 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.42 134.97 23.54 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 122.305 2.003 . . . . 0.0 112.483 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.3 mt -72.83 -41.22 65.09 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.93 171.57 37.03 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.1 t 57.47 80.45 0.17 Allowed 'General case' 0 C--O 1.242 0.676 0 C-N-CA 123.552 0.741 . . . . 0.0 111.174 179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.7 mtp -69.63 133.53 47.68 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.464 ' O ' ' HA ' ' A' ' 23' ' ' THR . 70.8 m -79.39 115.45 19.04 Favored 'General case' 0 N--CA 1.397 -3.099 0 CA-C-O 121.673 0.749 . . . . 0.0 111.891 -171.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.2 p -140.38 132.79 28.45 Favored 'General case' 0 N--CA 1.399 -3.023 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.04 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 21' ' ' THR . 43.5 t -107.11 127.96 62.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.534 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 62.7 m-70 -79.66 105.64 11.1 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 174.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.2 p90 -118.0 142.3 47.52 Favored 'General case' 0 C--N 1.28 -2.426 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -123.65 124.27 42.39 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 118.77 -1.172 . . . . 0.0 110.199 174.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.438 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -80.32 157.89 26.26 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 177.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 m -56.89 -37.68 71.72 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.042 0.448 . . . . 0.0 110.229 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 p -88.06 -8.59 55.32 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.43 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 31.5 tptt -83.37 -37.73 22.93 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 tt 73.65 -51.78 0.7 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 125.726 1.61 . . . . 0.0 109.571 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -100.18 170.01 8.75 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -88.2 155.66 19.64 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.22 0.533 . . . . 0.0 111.095 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.534 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.6 t70 -128.33 178.53 6.2 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -133.78 117.88 17.4 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 119.366 0.984 . . . . 0.0 112.258 -173.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.581 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.4 p -99.9 123.14 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.7 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 7' ' ' SER . 36.1 p -92.03 143.06 26.85 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.968 -177.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -154.6 172.23 18.18 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.681 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.59 133.0 43.56 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.229 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.85 178.59 21.58 Favored Glycine 0 C--N 1.292 -1.915 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.03 -33.96 19.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.427 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -137.78 164.1 29.74 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.011 -179.15 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.0 tt -134.1 131.08 55.44 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.548 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m -63.58 143.16 58.06 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.9 tp -54.54 -40.08 68.32 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.27 1.428 . . . . 0.0 113.351 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.527 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.5 t -55.96 -45.89 78.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.719 0.295 . . . . 0.0 110.539 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.88 -41.73 70.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.26 -46.13 85.05 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.978 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.7 mtmt -61.73 -42.56 99.12 Favored 'General case' 0 C--O 1.206 -1.199 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.45 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.527 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.75 -35.11 77.15 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.27 0.356 . . . . 0.0 111.849 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -70.64 -45.68 64.72 Favored 'General case' 0 C--O 1.21 -1.009 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.109 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.4 -38.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.846 0.355 . . . . 0.0 111.348 -178.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.5 mtt -63.7 -38.99 93.2 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.6 -31.8 60.24 Favored Glycine 0 C--O 1.219 -0.833 0 N-CA-C 111.771 -0.531 . . . . 0.0 111.771 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.488 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 24.9 tpt180 -64.59 -51.36 63.15 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 124.818 1.247 . . . . 0.0 110.865 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -94.63 -17.95 21.82 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 80.4 70.14 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 125.811 1.645 . . . . 0.0 111.825 -176.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -97.55 165.93 11.75 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 114.803 -1.089 . . . . 0.0 111.793 176.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -107.19 101.79 11.16 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.235 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.77 -13.98 60.66 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.925 -173.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.52 2.38 56.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.721 0.772 . . . . 0.0 110.374 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -119.21 -36.26 3.42 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.742 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.3 p -139.22 162.48 34.89 Favored 'General case' 0 C--N 1.297 -1.695 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.806 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.454 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 40.4 t0 -114.6 166.58 11.58 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 tp -117.33 105.54 12.28 Favored 'General case' 0 C--N 1.263 -3.153 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -90.93 123.42 34.41 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.8 mm -110.84 135.22 50.62 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.571 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.0 m -123.19 140.73 52.72 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.558 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.9 t-20 -71.52 139.68 49.62 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -29.66 55.88 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.631 0.729 . . . . 0.0 110.687 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -94.32 -49.64 5.62 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.127 -173.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.4 p -93.18 -18.23 22.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.291 0.567 . . . . 0.0 109.475 -175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 42.0 mmtm 65.15 22.55 12.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.603 1.161 . . . . 0.0 112.242 -177.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -78.06 129.26 35.02 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -83.73 136.89 34.0 Favored 'General case' 0 N--CA 1.412 -2.373 0 CA-C-O 121.336 0.588 . . . . 0.0 109.595 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -96.13 98.73 10.57 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 3.2 p -91.8 -40.98 10.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -175.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -91.87 147.45 22.96 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.448 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 13.5 m-20 -66.06 -16.03 63.58 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.887 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -88.96 -1.33 58.05 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.201 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.42 145.4 55.72 Favored 'General case' 0 C--O 1.209 -1.076 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.427 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.06 137.73 52.71 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 119.928 -0.709 . . . . 0.0 112.696 -172.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.13 117.97 40.75 Favored Pre-proline 0 C--N 1.312 -1.024 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.87 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.406 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 64.4 Cg_endo -81.83 154.48 17.58 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.083 2.522 . . . . 0.0 112.827 174.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.432 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.17 -10.72 56.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -87.76 -2.05 58.36 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.319 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 55.2 m -106.92 140.0 40.42 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.302 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 m -100.0 131.67 45.82 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 172.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 27.0 m -125.88 159.86 33.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -176.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 mm -105.07 135.34 43.5 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 45.5 t -111.73 117.66 55.67 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-O 120.973 0.416 . . . . 0.0 110.085 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -119.38 122.9 42.84 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.407 0.683 . . . . 0.0 109.993 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -77.97 121.6 24.41 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pp -121.37 146.72 45.55 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.867 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.03 135.47 23.15 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.344 2.029 . . . . 0.0 111.043 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.454 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.8 pt -80.57 -27.69 11.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.1 -79.65 1.69 Allowed Glycine 0 N--CA 1.419 -2.455 0 N-CA-C 108.781 -1.727 . . . . 0.0 108.781 -173.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.22 41.29 0.45 Allowed Glycine 0 N--CA 1.418 -2.553 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.027 178.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 38.5 t -78.63 86.7 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -177.55 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.989 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.11 125.53 18.38 Favored 'Trans proline' 0 C--O 1.244 0.798 0 C-N-CA 122.737 2.291 . . . . 0.0 110.811 176.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.6 mt -101.42 142.97 32.02 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.15 -38.94 24.77 Favored Glycine 0 N--CA 1.436 -1.342 0 N-CA-C 111.277 -0.729 . . . . 0.0 111.277 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m 62.54 27.41 16.22 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.279 1.031 . . . . 0.0 110.733 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 92.5 mmm 55.94 98.67 0.02 OUTLIER 'General case' 0 CA--C 1.494 -1.174 0 C-N-CA 124.709 1.204 . . . . 0.0 111.475 -171.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.581 ' O ' ' HA ' ' A' ' 23' ' ' THR . 3.3 m -63.17 120.24 11.12 Favored 'General case' 0 C--N 1.281 -2.37 0 CA-C-N 112.863 -1.971 . . . . 0.0 108.021 -175.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.3 p -138.11 134.17 34.31 Favored 'General case' 0 N--CA 1.419 -2.007 0 C-N-CA 119.542 -0.863 . . . . 0.0 111.855 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.437 HG22 ' CE1' ' A' ' 24' ' ' PHE . 74.5 t -106.67 125.59 62.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 175.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -77.82 119.75 21.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.646 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 43.1 p90 -133.98 138.55 45.51 Favored 'General case' 0 C--N 1.286 -2.176 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -118.46 146.12 44.73 Favored 'General case' 0 N--CA 1.426 -1.649 0 C-N-CA 118.433 -1.307 . . . . 0.0 107.678 173.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -92.87 169.4 10.49 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -63.7 -16.68 61.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.901 0.857 . . . . 0.0 110.708 174.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.0 m -138.15 107.85 6.25 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 171.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 12.4 tppt? -177.81 -39.23 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -176.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.0 tp 76.71 -52.53 0.58 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.905 1.682 . . . . 0.0 111.136 -178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -102.01 172.65 6.79 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -94.99 143.38 26.52 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-O 121.24 0.543 . . . . 0.0 109.672 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -104.6 177.76 4.75 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 175.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.13 116.29 9.44 Favored 'General case' 0 C--N 1.275 -2.642 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -173.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 15.0 p -95.16 116.94 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.782 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.581 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.2 p -89.42 124.36 34.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.587 0.708 . . . . 0.0 112.201 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.437 ' CE1' HG22 ' A' ' 9' ' ' VAL . 31.6 p90 -132.92 177.17 7.86 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -176.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -113.8 136.1 53.23 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.95 174.48 17.17 Favored Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -82.12 -35.58 28.38 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.484 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -135.08 159.24 42.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -179.753 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.4 tt -127.4 126.14 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.572 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.0 m -59.74 141.36 55.35 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.957 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.436 HD13 ' CG1' ' A' ' 53' ' ' ILE . 56.8 tp -55.24 -40.91 71.43 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 123.973 0.909 . . . . 0.0 112.045 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.727 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 9.3 t -56.3 -46.66 79.71 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.593 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.8 t70 -68.05 -43.92 77.57 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 -177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.22 -46.61 89.71 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.883 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HD2' ' O ' ' A' ' 51' ' ' LEU . 44.2 mtmt -67.13 -40.48 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.707 0.289 . . . . 0.0 110.645 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.727 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.3 mptt -65.03 -34.09 77.61 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.093 178.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 83.2 mm-40 -62.13 -49.95 73.84 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.353 0.596 . . . . 0.0 109.495 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.3 mt -67.76 -47.85 78.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.627 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.1 mtm -63.33 -37.24 86.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.853 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.43 61.89 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.154 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -72.39 -49.55 33.01 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 122.628 0.371 . . . . 0.0 111.548 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 44.2 mt-10 -93.45 -1.74 55.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 18.9 mmtp 71.75 45.02 0.45 Allowed 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.411 1.085 . . . . 0.0 111.225 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.7 mp -73.34 162.99 28.71 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.942 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HB3' ' HZ2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -92.46 100.28 12.86 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.133 178.565 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.07 -14.73 58.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.887 -173.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.68 -4.39 23.83 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.878 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -103.1 -42.55 5.74 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.972 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.4 m -133.65 166.17 23.24 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.7 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -108.13 162.14 14.33 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.491 HD12 ' CG1' ' A' ' 77' ' ' VAL . 33.1 tp -107.44 125.05 50.75 Favored 'General case' 0 C--N 1.251 -3.674 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.527 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.2 tt0 -110.67 128.93 55.91 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 -178.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.436 ' CG1' HD13 ' A' ' 31' ' ' LEU . 44.7 mm -113.31 133.62 58.62 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -176.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 m -116.71 153.39 32.46 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -83.86 146.51 28.05 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.08 -12.45 28.48 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.267 0.556 . . . . 0.0 111.187 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -103.76 -39.64 6.58 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.096 -176.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -100.04 -25.11 14.42 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.8 mmmm 68.84 24.93 6.33 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.099 1.359 . . . . 0.0 111.131 -176.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -90.24 135.51 33.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.731 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -78.81 141.53 37.67 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 121.043 0.449 . . . . 0.0 110.959 175.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -103.21 99.4 9.25 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 173.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 p -82.22 -31.18 30.42 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.402 ' O ' HD22 ' A' ' 31' ' ' LEU . 2.2 m-20 -105.87 139.42 40.46 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.513 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -63.19 -7.25 5.51 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.066 0.946 . . . . 0.0 111.454 178.179 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -90.63 -0.16 57.59 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.368 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.04 152.05 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.484 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.76 137.35 53.42 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 118.21 0.459 . . . . 0.0 110.36 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -116.34 117.3 38.75 Favored Pre-proline 0 C--N 1.304 -1.386 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.652 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.7 Cg_endo -79.77 159.7 24.72 Favored 'Trans proline' 0 C--N 1.323 -0.779 0 C-N-CA 122.936 2.424 . . . . 0.0 112.683 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.1 pttt -70.59 1.01 5.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.486 0.66 . . . . 0.0 111.327 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -87.81 -11.26 48.49 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.8 m -122.21 149.35 43.79 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 121.389 0.614 . . . . 0.0 112.56 -172.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 m -103.43 133.28 48.75 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.646 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 19.2 m -126.25 169.78 17.18 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 CA-C-O 120.924 0.392 . . . . 0.0 111.026 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mt -123.95 136.11 61.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 123.704 0.802 . . . . 0.0 109.012 -177.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.491 ' CG1' HD12 ' A' ' 51' ' ' LEU . 26.3 t -106.23 128.58 60.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.472 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -136.73 133.4 36.04 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -89.62 132.42 35.13 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -131.44 152.65 80.85 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 118.215 0.461 . . . . 0.0 110.318 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.77 128.8 17.5 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 121.795 1.663 . . . . 0.0 110.875 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.4 pt -50.69 -44.53 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 CA-C-O 121.073 0.463 . . . . 0.0 111.846 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -127.53 -51.98 0.14 Allowed Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 163.89 -75.3 0.17 Allowed Glycine 0 CA--C 1.472 -2.625 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 28.3 m -72.74 135.34 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 172.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.8 pttp . . . . . 0 C--N 1.284 -2.277 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -171.769 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.45 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -86.35 168.19 8.85 Favored 'Trans proline' 0 C--O 1.248 1.011 0 C-N-CA 122.962 2.442 . . . . 0.0 112.123 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.4 tp -68.62 -32.66 72.69 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.74 38.41 2.94 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.49 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.0 t -67.19 -45.07 78.01 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.213 1.006 . . . . 0.0 109.573 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 95.7 mmm -91.91 -179.82 5.4 Favored 'General case' 0 C--N 1.273 -2.725 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.807 178.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.511 ' O ' ' HA ' ' A' ' 23' ' ' THR . 41.9 m -96.22 127.06 41.89 Favored 'General case' 0 C--N 1.275 -2.665 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.797 -175.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.1 p -148.53 135.19 19.78 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.357 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.531 HG22 ' CE1' ' A' ' 24' ' ' PHE . 98.3 t -107.06 134.43 48.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -84.0 109.68 17.83 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -127.82 138.97 52.9 Favored 'General case' 0 C--N 1.277 -2.555 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -121.03 137.52 54.61 Favored 'General case' 0 C--N 1.281 -2.398 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -90.42 156.77 17.98 Favored 'General case' 0 C--N 1.283 -2.29 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.6 m -56.92 -29.19 62.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.899 0.381 . . . . 0.0 111.007 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.6 m -83.76 -10.96 57.74 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.311 0.644 . . . . 0.0 111.813 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -101.19 156.98 17.11 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 122.107 -0.37 . . . . 0.0 110.873 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.9 mt -97.56 -43.24 7.31 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.736 0.779 . . . . 0.0 108.949 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -114.54 167.64 10.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.394 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -76.12 149.1 37.44 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.948 0.88 . . . . 0.0 112.779 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -112.16 177.11 4.75 Favored 'General case' 0 C--N 1.28 -2.441 0 N-CA-C 105.126 -2.175 . . . . 0.0 105.126 174.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.442 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -140.18 113.53 8.49 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 118.612 0.642 . . . . 0.0 110.354 -174.035 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 12.2 p -96.3 124.07 48.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.402 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 7' ' ' SER . 13.3 p -87.3 140.07 29.92 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.648 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.531 ' CE1' HG22 ' A' ' 9' ' ' VAL . 33.0 p90 -148.08 167.36 25.18 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 120.987 0.423 . . . . 0.0 110.736 -178.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -101.63 116.15 32.1 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.611 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.42 177.07 15.46 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 110.435 -1.066 . . . . 0.0 110.435 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.3 tp -77.52 -30.98 53.14 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 122.021 0.915 . . . . 0.0 109.529 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.568 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.76 158.72 43.46 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.533 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 tt -124.53 128.1 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.103 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 m -62.1 142.3 57.65 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.944 175.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 58.2 tp -54.41 -39.87 67.71 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 125.301 1.441 . . . . 0.0 112.262 -176.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.55 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -55.83 -46.19 78.18 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 123.24 0.337 . . . . 0.0 110.602 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.1 t70 -73.34 -39.08 65.49 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -175.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.76 -46.19 89.19 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.05 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 53.4 mtmt -66.32 -39.76 89.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.0 mptp? -61.71 -40.35 94.72 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.275 178.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 64.6 mt-30 -66.9 -50.32 62.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.445 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.72 -43.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.631 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.482 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 71.1 mtm -64.27 -45.07 89.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.74 -178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.38 -33.89 61.09 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.965 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -75.09 -46.75 32.56 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 32.2 mm-40 -94.24 13.13 24.36 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp 68.16 34.04 4.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.518 1.127 . . . . 0.0 111.873 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 10.5 mp -74.62 174.19 9.39 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.172 0.987 . . . . 0.0 112.819 -178.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.524 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 13.2 ptpt -109.82 108.28 18.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.618 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.37 -20.71 31.52 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -175.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -107.04 -15.13 14.76 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.947 0.403 . . . . 0.0 111.343 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.524 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 14.4 t70 -92.56 -27.66 17.23 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -176.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.696 ' SG ' ' HA ' ' A' ' 86' ' ' LYS . 73.4 m -147.94 167.51 24.66 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -110.87 169.5 8.72 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.2 tp -127.52 119.78 26.8 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.492 ' HB2' HG12 ' A' ' 80' ' ' ILE . 39.4 tt0 -121.63 136.98 54.92 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -115.39 135.62 54.79 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.904 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -176.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 m -121.51 146.03 47.35 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.489 ' HA ' HG11 ' A' ' 75' ' ' VAL . 13.8 t-20 -74.64 137.22 42.1 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.77 43.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.364 0.602 . . . . 0.0 111.205 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -100.06 -52.84 3.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.929 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.3 p -92.23 -16.59 25.97 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.6 mmmm 68.41 17.13 9.19 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.749 1.219 . . . . 0.0 111.463 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -81.4 132.42 35.32 Favored 'General case' 0 N--CA 1.433 -1.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -83.85 146.71 27.95 Favored 'General case' 0 N--CA 1.415 -2.195 0 CA-C-O 121.577 0.703 . . . . 0.0 110.416 178.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -107.22 103.83 13.3 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -100.38 -36.99 9.04 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -88.61 140.01 29.89 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 2.0 m-20 -68.61 -10.79 58.17 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -88.83 -4.45 58.49 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.035 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 142.89 58.24 Favored 'General case' 0 C--O 1.208 -1.095 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.568 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -117.14 137.79 52.08 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.586 -173.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.62 117.87 37.54 Favored Pre-proline 0 C--N 1.306 -1.323 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 91.2 Cg_endo -81.3 160.22 20.09 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 123.233 2.622 . . . . 0.0 114.063 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -67.96 -9.19 43.37 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.889 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -87.91 -1.57 58.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.423 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.9 m -121.01 157.34 30.2 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 121.406 0.622 . . . . 0.0 112.233 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 m -115.06 130.83 57.03 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 174.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 55' ' ' ASN . 29.4 m -127.26 160.22 36.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.46 0.647 . . . . 0.0 112.694 -175.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.4 mm -104.0 123.86 58.01 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.6 t -104.43 120.12 54.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -127.13 130.51 49.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.239 -172.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -83.52 120.93 26.54 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.492 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -117.59 156.62 49.22 Favored Pre-proline 0 C--N 1.313 -0.985 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.735 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.445 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 26.0 Cg_endo -64.32 131.09 28.87 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.231 1.954 . . . . 0.0 112.798 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 pt -64.0 -24.57 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-O 121.635 0.731 . . . . 0.0 109.616 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -162.05 -58.78 0.02 OUTLIER Glycine 0 N--CA 1.425 -2.042 0 N-CA-C 107.375 -2.29 . . . . 0.0 107.375 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -140.62 -28.08 0.2 Allowed Glycine 0 N--CA 1.431 -1.682 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 81' ' ' PRO . 7.2 t -69.43 115.78 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-O 121.301 0.572 . . . . 0.0 109.807 178.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.696 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 2.4 pptp? . . . . . 0 C--N 1.289 -2.035 0 C-N-CA 125.821 1.649 . . . . 0.0 106.735 175.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.605 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -82.57 41.86 1.19 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.364 2.709 . . . . 0.0 112.676 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pp -130.39 160.11 35.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.716 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.99 56.17 4.82 Favored Glycine 0 CA--C 1.517 0.203 0 CA-C-O 121.345 0.414 . . . . 0.0 113.59 -176.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.3 m -153.81 92.65 1.58 Allowed 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.8 ptp -163.06 179.71 7.32 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.518 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 50.3 m -108.61 114.7 28.72 Favored 'General case' 0 N--CA 1.422 -1.845 0 C-N-CA 119.728 -0.789 . . . . 0.0 110.301 176.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.0 p -132.95 135.72 45.69 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.85 -177.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.8 t -110.29 126.61 67.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -82.4 111.34 18.36 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.621 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.2 p90 -127.36 139.91 52.54 Favored 'General case' 0 C--N 1.28 -2.44 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -123.1 139.28 54.24 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.001 -1.48 . . . . 0.0 107.876 174.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -78.7 171.23 15.45 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -57.77 -37.54 73.85 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 123.28 0.632 . . . . 0.0 111.867 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.7 m -102.22 9.78 39.79 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-O 121.067 0.46 . . . . 0.0 111.918 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -92.71 135.19 34.32 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.2 mt -96.79 -24.12 16.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.428 0.632 . . . . 0.0 109.796 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -107.13 165.18 11.55 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -92.63 138.59 31.37 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.289 0.566 . . . . 0.0 110.219 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 173.24 7.79 Favored 'General case' 0 C--N 1.281 -2.37 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 175.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.51 128.95 30.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -111.86 138.89 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.222 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 176.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -116.7 143.84 45.15 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.1 p90 -153.7 176.81 11.68 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -125.81 130.56 51.65 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.403 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.34 -114.63 1.19 Allowed Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -140.9 -45.75 0.39 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.571 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -141.5 158.45 43.83 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -177.36 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -125.43 129.78 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.289 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -63.86 149.52 46.85 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 122.881 0.472 . . . . 0.0 110.471 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 tp -57.61 -44.75 85.7 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -174.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.531 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 50.4 t -56.64 -45.51 81.53 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.953 177.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.96 -42.31 94.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.416 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -62.67 -47.47 83.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.267 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' HD21 ' A' ' 51' ' ' LEU . 52.6 mtmt -67.21 -41.82 85.13 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.275 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.531 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -61.7 -35.18 77.3 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -69.1 -49.15 59.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 0.0 110.546 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.2 mt -69.56 -44.09 79.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.311 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.94 -37.34 86.66 Favored 'General case' 0 CA--C 1.51 -0.591 0 O-C-N 122.23 -0.294 . . . . 0.0 111.34 -178.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.94 -41.58 87.52 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -66.89 -38.07 85.59 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 123.079 0.551 . . . . 0.0 112.119 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.96 11.87 37.83 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.967 0.413 . . . . 0.0 111.158 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? 59.34 38.36 23.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.513 172.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.13 152.91 40.98 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -83.85 100.48 10.99 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.36 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.41 -8.3 59.41 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.195 -173.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 6.69 42.59 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.155 0.503 . . . . 0.0 109.993 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.544 ' O ' HG12 ' A' ' 82' ' ' ILE . 13.2 t70 -130.23 -40.84 1.28 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.403 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.78 172.54 9.23 Favored 'General case' 0 N--CA 1.418 -2.059 0 CA-C-O 121.552 0.691 . . . . 0.0 111.241 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -126.3 166.74 16.57 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.437 HD21 ' HA ' ' A' ' 35' ' ' LYS . 19.9 tp -111.32 118.29 35.48 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.456 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.4 tp60 -104.51 126.13 51.31 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -108.92 135.23 48.44 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.7 m -127.17 136.68 52.41 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.473 ' HA ' HG13 ' A' ' 75' ' ' VAL . 12.3 t-20 -64.97 135.09 55.25 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 117.892 0.314 . . . . 0.0 110.3 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.9 -23.26 58.34 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.228 0.537 . . . . 0.0 110.786 -178.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -94.98 -55.81 2.96 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.874 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -92.72 -15.78 26.26 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.891 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.95 21.23 12.54 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.537 0.735 . . . . 0.0 112.458 -174.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -71.96 117.86 14.1 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -81.52 138.91 35.4 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.07 96.98 7.59 Favored 'General case' 0 C--N 1.274 -2.712 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.2 p -94.59 -20.02 19.98 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.742 -175.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.64 129.46 45.78 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.574 -174.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -71.22 -7.59 47.86 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.709 0.686 . . . . 0.0 112.191 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -93.07 2.15 56.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.27 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.31 147.64 49.41 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 175.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.571 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.54 138.35 51.96 Favored 'General case' 0 C--N 1.28 -2.428 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.685 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -113.96 114.33 46.47 Favored Pre-proline 0 C--N 1.307 -1.279 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.858 175.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.464 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.3 Cg_endo -77.75 161.28 30.68 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.097 2.532 . . . . 0.0 112.806 175.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 19.9 pttm -66.92 -8.86 32.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.789 0.804 . . . . 0.0 111.219 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.61 -3.22 58.98 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.497 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.2 m -114.72 125.48 53.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 120.903 0.382 . . . . 0.0 111.404 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.0 m -90.26 123.58 34.16 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.621 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 23.6 m -123.54 155.12 29.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.431 0.634 . . . . 0.0 112.598 -175.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.26 132.23 48.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.409 ' CG1' HD12 ' A' ' 51' ' ' LEU . 70.5 t -105.93 125.46 61.43 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.577 -176.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -131.42 145.24 51.71 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 ttp85 -99.96 126.29 46.1 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 122.051 -0.406 . . . . 0.0 109.987 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.456 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.66 155.61 66.0 Favored Pre-proline 0 C--N 1.314 -0.976 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -178.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.28 131.33 15.06 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.316 2.01 . . . . 0.0 111.94 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 48' ' ' ASP . 12.4 pt -62.19 -41.97 93.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.511 0.196 . . . . 0.0 111.323 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 178.67 29.41 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.255 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -99.84 -64.62 0.82 Allowed Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 44.8 t -77.22 98.13 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.5 pttp . . . . . 0 C--N 1.299 -1.629 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -176.081 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.789 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.63 161.88 39.54 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 122.352 2.035 . . . . 0.0 111.538 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.3 mt -78.43 69.06 4.56 Favored 'General case' 0 C--O 1.249 1.032 0 CA-C-O 121.693 0.758 . . . . 0.0 111.056 -177.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.78 179.55 17.79 Favored Glycine 0 N--CA 1.425 -2.043 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.954 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t 66.09 15.33 10.04 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 124.622 1.169 . . . . 0.0 112.126 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 75.3 mtp -98.99 174.35 6.39 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.631 -177.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.5 m -86.78 111.59 20.87 Favored 'General case' 0 N--CA 1.409 -2.482 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 18.3 p -124.07 135.42 53.55 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.437 -175.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 21' ' ' THR . 54.0 t -107.93 124.77 64.34 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.418 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 80.2 m-70 -78.04 110.59 13.12 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.518 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.514 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 31.0 p90 -128.47 141.37 51.41 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -177.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.408 ' HE3' HD11 ' A' ' 76' ' ' ILE . 18.6 pttp -117.11 130.94 56.97 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.341 -1.344 . . . . 0.0 107.894 172.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.404 ' CZ ' HD22 ' A' ' 44' ' ' LEU . 1.9 t80 -85.03 163.44 18.85 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.516 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 11.5 m -56.9 -24.99 56.09 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 123.398 0.679 . . . . 0.0 111.515 175.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.5 m -94.9 -8.58 36.72 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.537 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -112.22 124.46 52.5 Favored 'General case' 0 CA--C 1.506 -0.728 0 O-C-N 121.869 -0.519 . . . . 0.0 110.348 -176.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mp -88.92 -4.87 58.33 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.509 0.671 . . . . 0.0 110.43 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -122.22 167.43 13.22 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -91.02 143.7 26.43 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.591 0.71 . . . . 0.0 112.321 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.6 t70 -111.83 177.88 4.5 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -140.21 117.45 11.29 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 118.21 0.459 . . . . 0.0 110.951 -174.435 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.6 142.07 14.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.8 p -116.29 133.26 56.21 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -174.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 28.2 p90 -143.12 177.03 8.67 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.602 1.161 . . . . 0.0 107.927 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -120.62 128.35 52.94 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.01 -114.03 1.04 Allowed Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.509 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -145.02 -42.45 0.23 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.508 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.08 153.36 42.1 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.4 tt -121.53 132.42 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.852 -178.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.428 ' HB2' ' OD1' ' A' ' 33' ' ' ASP . 37.5 m -64.75 146.52 54.68 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.03 176.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.58 -43.34 84.51 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 124.528 1.131 . . . . 0.0 113.257 -174.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.593 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 37.4 t -56.88 -45.83 82.26 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 30' ' ' SER . 9.0 m-20 -63.38 -47.46 81.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.663 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.56 -47.47 84.13 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.521 1.128 . . . . 0.0 110.708 -176.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.404 ' HA ' HD21 ' A' ' 51' ' ' LEU . 53.7 mtmt -69.35 -43.48 73.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.952 -178.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.9 mptp? -61.85 -39.38 91.65 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 90.8 mt-30 -64.99 -50.57 65.81 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.7 mt -63.91 -47.54 90.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.884 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.95 -33.61 76.45 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.268 -178.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.66 -43.23 36.88 Favored Glycine 0 C--N 1.312 -0.797 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.268 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -59.52 -42.46 92.29 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 125.093 1.357 . . . . 0.0 111.838 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 33.6 mt-10 -104.05 8.92 36.63 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.043 -175.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.72 64.23 1.35 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.277 175.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.445 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -99.73 -176.36 3.24 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.896 177.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -107.47 100.62 10.03 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.88 0.848 . . . . 0.0 110.423 174.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.56 -18.33 38.7 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.719 -176.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.63 9.21 35.73 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.908 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.601 ' O ' HG12 ' A' ' 82' ' ' ILE . 23.8 t70 -133.36 -47.2 0.83 Allowed 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.762 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.9 m -112.63 176.95 4.8 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.892 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 80' ' ' ILE . 37.2 t70 -124.09 163.08 22.21 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.3 tp -118.5 108.96 15.64 Favored 'General case' 0 N--CA 1.397 -3.104 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.559 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.3 tp-100 -91.39 120.81 32.57 Favored 'General case' 0 C--N 1.284 -2.255 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.408 ' CD1' HG11 ' A' ' 77' ' ' VAL . 35.2 mm -110.8 127.87 67.58 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.038 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -174.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 m -122.32 140.02 53.14 Favored 'General case' 0 C--N 1.268 -2.946 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.438 ' HA ' HG13 ' A' ' 75' ' ' VAL . 11.5 t-20 -65.37 131.83 47.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.87 -30.77 70.22 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.284 0.564 . . . . 0.0 110.746 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -91.48 -58.28 2.49 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.161 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.7 p -85.66 -14.94 43.99 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.038 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 44.4 mmtm 65.25 20.54 11.92 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.045 0.938 . . . . 0.0 111.685 -177.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.82 119.75 14.52 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.957 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -85.39 138.25 32.4 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-O 121.309 0.576 . . . . 0.0 109.92 177.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -100.61 90.42 4.26 Favored 'General case' 0 C--N 1.278 -2.504 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -82.48 -39.61 22.24 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.073 -175.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.699 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 6.8 m-20 -85.53 138.73 32.0 Favored 'General case' 0 CA--C 1.482 -1.638 0 CA-C-N 116.717 -0.219 . . . . 0.0 110.873 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -66.57 -12.37 57.5 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.267 0.556 . . . . 0.0 111.239 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.699 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 8.7 p30 -92.87 1.01 57.51 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.43 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.86 151.64 46.32 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.508 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -118.71 138.02 52.93 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 118.137 0.426 . . . . 0.0 111.384 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.92 115.93 43.11 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.927 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.44 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 48.6 Cg_endo -75.67 153.61 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.867 2.378 . . . . 0.0 113.472 175.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -63.67 -18.22 63.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.561 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -85.53 -4.93 59.31 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.655 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 43.5 m -116.88 139.29 50.8 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 120.906 0.384 . . . . 0.0 111.188 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 t -96.53 135.67 38.1 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -128.82 157.0 41.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 CA-C-O 121.251 0.548 . . . . 0.0 111.693 -177.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.408 HD11 ' HE3' ' A' ' 12' ' ' LYS . 31.3 mm -102.04 132.69 47.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.412 HG22 ' HB2' ' A' ' 11' ' ' TYR . 54.4 t -110.33 107.23 22.38 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.144 0 CA-C-O 121.442 0.639 . . . . 0.0 110.145 -175.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.516 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 12.0 tpt180 -110.34 123.7 50.33 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.199 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -81.66 122.62 27.86 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 176.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -125.81 156.59 71.04 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 120.477 0.179 . . . . 0.0 110.779 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.86 135.94 24.35 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 122.378 2.052 . . . . 0.0 111.11 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 48' ' ' ASP . 12.5 pt -62.13 -27.94 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.48 -69.79 0.3 Allowed Glycine 0 N--CA 1.423 -2.174 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.7 -92.51 0.09 OUTLIER Glycine 0 N--CA 1.421 -2.32 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 46.5 t -118.1 108.66 24.97 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 122.817 -0.225 . . . . 0.0 110.567 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? . . . . . 0 C--N 1.308 -1.227 0 C-N-CA 123.653 0.781 . . . . 0.0 109.744 175.954 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.493 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -76.54 47.84 2.22 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 123.966 3.11 . . . . 0.0 111.007 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.6 mt -98.86 80.75 2.54 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -176.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.94 -61.66 4.74 Favored Glycine 0 N--CA 1.46 0.284 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 -174.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.5 t -165.87 -62.03 0.03 OUTLIER 'General case' 0 N--CA 1.422 -1.847 0 N-CA-C 104.67 -2.344 . . . . 0.0 104.67 173.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp -148.75 136.85 20.92 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 112.957 -1.929 . . . . 0.0 106.015 175.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.606 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.1 m -76.73 120.83 22.44 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.9 p -137.93 140.45 40.3 Favored 'General case' 0 N--CA 1.419 -2.0 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.694 -176.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.404 HG21 ' CE1' ' A' ' 24' ' ' PHE . 77.3 t -106.78 124.69 62.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -79.78 114.61 18.84 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 175.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.0 p90 -130.36 141.16 50.58 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -130.56 136.83 49.3 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.57 173.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -86.08 165.67 16.45 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -175.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -58.51 -31.61 68.06 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.845 0.831 . . . . 0.0 108.957 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 m -84.32 -13.65 51.83 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 114.9 -1.045 . . . . 0.0 112.049 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HD2' ' OE1' ' A' ' 42' ' ' GLU . 54.6 mtpt -116.08 126.46 53.78 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 121.885 -0.509 . . . . 0.0 111.252 -173.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.45 -41.01 48.93 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.086 -0.507 . . . . 0.0 112.063 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -104.86 159.56 15.7 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.031 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -77.29 136.96 38.53 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 121.341 0.591 . . . . 0.0 111.982 -177.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -100.24 172.83 6.92 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 p -138.29 122.53 18.14 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -94.37 113.63 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 7' ' ' SER . 6.1 p -88.14 111.18 21.31 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.301 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.606 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.9 p90 -128.17 154.8 45.39 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -96.23 101.58 13.25 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.681 0.753 . . . . 0.0 109.675 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 157.49 -174.32 34.94 Favored Glycine 0 C--N 1.287 -2.162 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.64 -42.53 7.21 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.19 150.74 47.05 Favored 'General case' 0 CA--C 1.484 -1.596 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.75 179.788 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -120.65 129.39 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.4 0 CA-C-N 115.025 -0.988 . . . . 0.0 111.299 -177.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.8 m -56.83 141.62 43.91 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.609 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.448 HD21 ' O ' ' A' ' 64' ' ' ASP . 57.7 tp -56.12 -41.87 75.97 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -176.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.554 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 43.4 t -58.34 -45.93 87.22 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 2.9 m-20 -66.49 -44.52 82.38 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.534 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -59.12 -46.35 88.57 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 124.302 1.041 . . . . 0.0 110.016 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.52 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.3 mtmt -64.18 -42.27 96.75 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.655 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.554 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.47 -38.63 87.94 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 12.6 mm100 -62.11 -47.97 82.26 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.317 0.579 . . . . 0.0 109.56 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.8 mt -68.72 -42.78 83.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.325 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.52 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.3 mtt -61.39 -40.82 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.22 0.208 . . . . 0.0 111.065 -178.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.25 -35.78 60.24 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.544 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.457 ' HD2' ' OH ' ' A' ' 11' ' ' TYR . 31.5 ttm180 -73.12 -44.55 60.07 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.833 0.349 . . . . 0.0 111.864 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.478 ' OE1' ' HD2' ' A' ' 16' ' ' LYS . 58.6 mm-40 -91.56 9.05 33.71 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.601 -176.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . 0.34 0.0 OUTLIER 45.55 66.52 0.9 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.004 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -93.81 145.27 24.72 Favored 'General case' 0 CA--C 1.491 -1.306 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.596 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.432 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 8.0 ptpp? -88.87 101.56 14.17 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.186 173.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.26 -13.79 59.87 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.019 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.21 8.56 23.45 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.62 0.724 . . . . 0.0 109.985 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.432 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 15.0 t70 -130.57 -45.19 1.08 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.563 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.558 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 13.3 p -132.72 167.86 19.37 Favored 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.236 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -123.01 170.99 9.59 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.467 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 13.9 tp -118.25 127.17 53.48 Favored 'General case' 0 C--N 1.265 -3.103 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.561 ' HA ' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -116.31 121.1 40.99 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.154 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 34.5 mm -106.73 135.57 44.7 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.7 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -173.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.8 m -122.72 148.02 45.8 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.491 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.4 t-20 -75.16 140.79 43.59 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.27 37.37 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.969 0.414 . . . . 0.0 111.278 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.565 ' HA ' HE21 ' A' ' 57' ' ' GLN . 0.0 OUTLIER -95.65 -47.3 6.27 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.855 -176.092 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -90.79 -21.45 21.51 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.164 0.507 . . . . 0.0 109.778 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.9 mmmt 66.74 26.7 9.46 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.475 1.11 . . . . 0.0 109.914 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -91.86 136.18 33.35 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -79.86 147.56 31.69 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.801 0.81 . . . . 0.0 111.382 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -103.9 95.88 6.31 Favored 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.6 p -80.44 -47.38 14.44 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 114.942 -1.026 . . . . 0.0 113.541 -172.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.448 ' O ' HD21 ' A' ' 31' ' ' LEU . 3.1 t70 -94.65 145.94 24.49 Favored 'General case' 0 CA--C 1.487 -1.455 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.397 -175.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.403 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 8.8 p-10 -69.72 -4.35 19.35 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -88.96 -7.11 56.64 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.971 175.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.49 150.41 48.9 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.417 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.78 138.13 52.89 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.598 -0.689 . . . . 0.0 111.609 -174.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -115.3 115.13 42.75 Favored Pre-proline 0 C--N 1.319 -0.732 0 C-N-CA 120.059 -0.657 . . . . 0.0 110.415 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.437 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 94.9 Cg_endo -80.48 153.89 20.93 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 C-N-CA 123.154 2.569 . . . . 0.0 113.19 176.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.4 pttt -59.24 -25.01 63.67 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.68 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -76.57 -5.56 48.21 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -116.13 133.88 55.54 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.408 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.8 m -91.48 137.0 32.71 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.552 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.4 m -128.0 154.14 38.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 CA-C-O 121.481 0.658 . . . . 0.0 111.87 -177.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.92 133.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.27 109.96 29.78 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-O 121.275 0.56 . . . . 0.0 110.326 -175.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -108.57 132.95 53.35 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.558 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 34.7 ttp85 -95.68 129.77 42.78 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.494 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -126.75 156.43 73.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.54 144.44 35.95 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.158 1.905 . . . . 0.0 111.978 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 48' ' ' ASP . 13.2 pt -82.42 -29.25 9.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-O 121.419 0.628 . . . . 0.0 109.44 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 131.76 -61.59 0.66 Allowed Glycine 0 N--CA 1.417 -2.588 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 -175.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.11 -97.6 0.59 Allowed Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.637 177.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 4.9 p -85.88 101.59 10.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.909 0.862 . . . . 0.0 110.024 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp . . . . . 0 C--N 1.302 -1.468 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.332 179.743 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.689 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.67 117.18 4.4 Favored 'Trans proline' 0 C--O 1.241 0.661 0 C-N-CA 122.716 2.277 . . . . 0.0 111.18 177.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -86.83 168.63 13.29 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.59 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.13 0.65 20.82 Favored Glycine 0 C--N 1.292 -1.877 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -175.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 m -95.42 0.88 53.88 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 121.115 0.483 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 70.8 mtp -82.57 111.2 18.35 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' A' ' 23' ' ' THR . 30.4 m -75.67 119.59 19.9 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.216 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.4 p -139.73 135.6 33.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.517 -177.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.506 ' O ' ' HA ' ' A' ' 21' ' ' THR . 78.9 t -106.9 125.12 62.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -76.91 108.94 10.31 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.533 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 44.5 p90 -127.22 135.63 50.91 Favored 'General case' 0 C--N 1.28 -2.418 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -115.8 136.08 53.4 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.05 160.84 16.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.449 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 16.1 m -58.32 -30.32 66.6 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.53 0.681 . . . . 0.0 110.058 174.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.1 m -86.04 1.61 49.64 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.607 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 138.43 54.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.015 0.912 . . . . 0.0 111.878 177.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -85.96 -27.1 25.12 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -110.2 172.05 7.09 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.611 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -92.11 139.59 30.48 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.224 0.535 . . . . 0.0 112.038 -176.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.13 175.37 5.5 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 173.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.506 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.9 p -137.42 131.3 31.78 Favored 'General case' 0 CA--C 1.48 -1.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.581 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 7.9 p -109.63 125.32 66.79 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 7' ' ' SER . 4.2 p -90.95 140.99 29.31 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.691 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.3 p90 -150.57 174.14 13.31 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -107.02 140.81 39.23 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.54 -175.02 18.55 Favored Glycine 0 C--N 1.298 -1.565 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 tt -90.06 -40.68 12.14 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.533 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -133.45 155.26 49.86 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.969 -1.014 . . . . 0.0 112.15 -178.273 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.3 tt -121.62 126.6 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.522 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.43 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 13.2 m -60.31 146.88 42.43 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.505 177.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.91 -38.12 78.18 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 123.751 0.821 . . . . 0.0 111.399 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.689 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.8 t -55.81 -46.9 77.94 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 175.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 22.2 m-20 -68.61 -41.91 78.87 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.352 -176.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.16 -46.67 70.12 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.035 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.6 mtmt -64.41 -42.86 95.82 Favored 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 121.307 -0.157 . . . . 0.0 111.365 -178.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.689 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.44 -36.82 81.45 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.418 0.449 . . . . 0.0 111.037 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 11.8 mm-40 -71.18 -44.37 65.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.334 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.5 mt -66.87 -40.42 85.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.508 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 59.9 mtt -60.36 -40.01 89.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.523 0.201 . . . . 0.0 110.511 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.8 -39.55 54.86 Favored Glycine 0 N--CA 1.438 -1.231 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.941 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -68.76 -49.55 57.78 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -82.37 -14.15 55.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.018 -173.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.7 mmtm 75.37 65.63 0.07 Allowed 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 125.85 1.66 . . . . 0.0 110.528 -178.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.75 152.64 19.46 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.696 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -104.82 102.13 11.7 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.907 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.37 -7.72 51.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.442 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -9.14 43.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.082 0.467 . . . . 0.0 110.545 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -112.1 -42.53 3.73 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.105 -178.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.8 m -129.86 171.67 12.48 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.03 -176.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.414 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 7.5 t70 -125.45 170.56 11.28 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.401 ' HG ' ' CD1' ' A' ' 53' ' ' ILE . 18.0 tp -120.9 115.78 23.89 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -173.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.44 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.6 tt0 -114.46 112.89 23.72 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.333 0.587 . . . . 0.0 110.277 -175.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.401 ' CD1' ' HG ' ' A' ' 51' ' ' LEU . 1.8 mp -99.01 135.27 34.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.793 -175.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -124.39 134.92 52.98 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 123.091 0.556 . . . . 0.0 109.513 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.469 ' HA ' HG13 ' A' ' 75' ' ' VAL . 13.2 t-20 -61.41 135.34 57.65 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.422 0.289 . . . . 0.0 110.277 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.41 -25.81 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.975 0.417 . . . . 0.0 111.442 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -93.34 -52.38 4.55 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.917 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.1 p -95.11 -15.84 23.07 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 62.47 26.61 15.84 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.799 0.809 . . . . 0.0 112.13 -174.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -73.17 116.66 13.96 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.29 126.65 34.97 Favored 'General case' 0 N--CA 1.42 -1.968 0 CA-C-O 121.397 0.618 . . . . 0.0 110.592 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -99.3 104.18 16.06 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-N 114.698 -1.137 . . . . 0.0 108.252 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.2 p -113.52 -2.37 13.89 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.745 0.783 . . . . 0.0 110.34 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -106.08 131.93 52.77 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.549 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -65.58 -12.6 54.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-O 121.311 0.576 . . . . 0.0 111.404 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -91.6 2.13 56.67 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.789 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.61 147.79 47.23 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 173.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.533 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.99 138.48 52.79 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.265 0.484 . . . . 0.0 110.979 -176.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.17 113.89 35.24 Favored Pre-proline 0 C--N 1.314 -0.965 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.218 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 69.2 Cg_endo -76.89 152.74 32.46 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.086 2.524 . . . . 0.0 113.379 176.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.9 pttt -59.29 -23.74 62.68 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -78.76 -17.18 56.21 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.792 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.9 m -100.03 139.87 35.07 Favored 'General case' 0 C--N 1.308 -1.201 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.358 -175.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -99.38 136.58 39.11 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.533 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.2 m -130.99 155.84 42.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 120.952 0.406 . . . . 0.0 110.66 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.18 130.82 55.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.0 t -105.78 113.23 42.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.318 -175.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.449 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 37.6 ttm180 -106.31 143.6 34.2 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.957 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -105.28 117.07 33.07 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.44 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -114.5 154.23 46.58 Favored Pre-proline 0 C--N 1.301 -1.535 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.406 -175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.35 143.75 31.85 Favored 'Trans proline' 0 C--N 1.325 -0.692 0 C-N-CA 122.621 2.214 . . . . 0.0 111.367 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.414 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 14.5 pt -84.47 -16.27 10.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.37 0.605 . . . . 0.0 110.063 177.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.5 -73.46 0.28 Allowed Glycine 0 N--CA 1.419 -2.472 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 178.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -135.0 151.68 20.52 Favored Glycine 0 N--CA 1.402 -3.627 0 N-CA-C 107.902 -2.079 . . . . 0.0 107.902 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.48 125.85 18.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 124.641 0.848 . . . . 0.0 112.011 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 pttm . . . . . 0 C--N 1.301 -1.512 0 CA-C-N 114.629 -1.168 . . . . 0.0 109.115 179.665 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.676 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.28 122.23 9.47 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 122.471 2.114 . . . . 0.0 111.906 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.6 mt -79.69 92.11 5.35 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.175 0.988 . . . . 0.0 110.677 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.5 165.97 25.14 Favored Glycine 0 N--CA 1.414 -2.828 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 47.9 t 70.79 16.38 6.7 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 123.852 0.861 . . . . 0.0 111.741 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.402 ' HE2' ' HB2' ' A' ' 6' ' ' MET . 47.8 mtm 60.2 -164.13 0.23 Allowed 'General case' 0 C--O 1.248 1.021 0 CA-C-O 121.816 0.817 . . . . 0.0 112.352 176.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 73.4 m -132.27 117.76 18.61 Favored 'General case' 0 N--CA 1.406 -2.637 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 34.4 m -133.1 134.86 44.83 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.069 -172.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 21' ' ' THR . 92.2 t -106.54 134.46 48.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 41.9 m-70 -84.22 123.06 29.71 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 123.775 0.672 . . . . 0.0 109.324 177.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.594 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 53.3 p90 -136.64 142.27 43.23 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.072 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -123.64 116.23 22.76 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 119.801 -0.759 . . . . 0.0 110.232 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.543 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 0.8 OUTLIER -68.77 165.61 19.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.435 -1.257 . . . . 0.0 111.275 178.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.4 m -56.61 -37.1 70.2 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.967 176.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.3 t -106.84 19.78 19.98 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.056 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -99.64 138.4 36.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.69 -31.72 16.48 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.647 0.737 . . . . 0.0 109.708 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -129.94 177.14 7.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -83.34 146.83 28.28 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.062 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.4 t70 -115.2 178.66 4.21 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.492 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -136.57 121.74 19.11 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 118.734 0.697 . . . . 0.0 110.677 -172.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.1 p -95.87 134.68 32.51 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.405 HG21 ' SG ' ' A' ' 8' ' ' CYS . 5.3 p -102.66 126.51 49.78 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.146 0.498 . . . . 0.0 111.494 -175.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 7' ' ' SER . 29.3 p90 -141.29 172.27 12.91 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -106.83 137.5 44.75 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.0 -167.05 12.36 Favored Glycine 0 N--CA 1.429 -1.82 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -98.03 -31.63 12.05 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.605 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.16 147.67 33.99 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -112.16 123.95 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.297 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.9 m -63.97 143.32 57.95 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.953 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.8 tp -54.84 -41.05 70.27 Favored 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 124.684 1.194 . . . . 0.0 112.533 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.633 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 32.2 t -53.18 -45.9 68.74 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 123.219 0.325 . . . . 0.0 110.339 176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.7 -39.8 61.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.523 0.678 . . . . 0.0 110.02 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.77 -47.21 85.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.287 -177.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.534 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.3 mtmt -70.68 -44.76 66.36 Favored 'General case' 0 C--O 1.203 -1.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.218 -178.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.633 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.0 mptp? -61.29 -37.71 84.16 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -175.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -64.64 -45.19 87.84 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.459 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.5 mt -73.95 -41.48 53.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.029 -176.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 88.8 mtp -62.25 -37.64 86.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.708 0.289 . . . . 0.0 110.576 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.46 -42.4 41.31 Favored Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.781 176.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -64.73 -47.65 77.48 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -89.09 11.16 19.24 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.488 -175.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? 55.06 62.09 2.66 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 123.94 0.896 . . . . 0.0 111.169 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -91.61 145.88 24.24 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.567 177.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.514 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -95.13 101.77 13.54 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.58 -8.55 55.78 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.964 -175.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -90.18 -1.73 57.97 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.932 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.488 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 16.6 t70 -129.08 -37.12 1.71 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.453 0.644 . . . . 0.0 110.474 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -128.78 166.12 19.62 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-O 121.814 0.816 . . . . 0.0 112.424 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.477 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 21.2 t0 -125.47 169.32 12.52 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 126.02 1.728 . . . . 0.0 106.687 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 35' ' ' LYS . 20.5 tp -117.42 111.25 19.06 Favored 'General case' 0 N--CA 1.404 -2.749 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.462 HE21 HG23 ' A' ' 80' ' ' ILE . 9.4 tt0 -109.34 111.23 22.67 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.593 0.711 . . . . 0.0 109.853 -178.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.417 ' CD1' HG21 ' A' ' 77' ' ' VAL . 18.7 mm -92.95 136.18 25.68 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -123.37 143.19 50.27 Favored 'General case' 0 C--N 1.275 -2.654 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -68.58 136.22 52.72 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 122.039 -0.413 . . . . 0.0 110.559 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -28.18 64.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -91.21 -58.18 2.54 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 121.186 0.517 . . . . 0.0 111.192 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 p -91.68 -17.44 25.47 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.195 -169.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.94 23.41 12.59 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.621 0.724 . . . . 0.0 112.549 -173.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.03 115.95 7.31 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -87.4 128.15 35.21 Favored 'General case' 0 N--CA 1.413 -2.293 0 CA-C-O 121.874 0.845 . . . . 0.0 110.174 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.2 93.53 8.73 Favored 'General case' 0 C--N 1.267 -2.995 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.062 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.8 p -98.36 -26.83 14.35 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.521 -1.218 . . . . 0.0 111.032 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -90.11 135.17 33.82 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.81 -13.15 62.22 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.895 0.379 . . . . 0.0 111.801 -176.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -83.59 -9.19 59.08 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.155 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.12 136.25 57.67 Favored 'General case' 0 C--O 1.2 -1.513 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.605 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -117.82 137.65 52.61 Favored 'General case' 0 C--N 1.281 -2.391 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.221 -176.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -117.04 118.79 35.74 Favored Pre-proline 0 C--N 1.297 -1.693 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.729 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 72.3 Cg_endo -78.68 157.94 28.23 Favored 'Trans proline' 0 C--N 1.324 -0.718 0 C-N-CA 123.218 2.612 . . . . 0.0 113.404 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 49.6 pttt -70.19 -5.48 27.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.9 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -87.83 -4.27 58.88 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.759 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -122.43 157.94 30.82 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-O 120.973 0.416 . . . . 0.0 111.247 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m -118.86 137.76 53.21 Favored 'General case' 0 N--CA 1.422 -1.837 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 12.5 m -130.48 163.85 35.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.48 0.657 . . . . 0.0 111.697 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 13.9 mm -109.47 132.28 58.05 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.543 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 1.7 p -112.78 106.55 20.99 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 122.173 0.987 . . . . 0.0 111.207 -177.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -103.26 131.79 50.03 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.843 -174.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -90.51 117.57 29.3 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.462 HG23 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -116.6 151.56 47.26 Favored Pre-proline 0 C--N 1.308 -1.219 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -177.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -75.38 138.08 21.7 Favored 'Trans proline' 0 CA--C 1.549 1.248 0 C-N-CA 122.399 2.066 . . . . 0.0 112.362 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.477 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 12.7 pt -76.86 -44.17 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.326 0.584 . . . . 0.0 110.663 177.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -176.68 64.77 0.09 OUTLIER Glycine 0 N--CA 1.429 -1.787 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -155.74 147.83 17.15 Favored Glycine 0 N--CA 1.427 -1.932 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.7 m -87.16 112.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.334 0 CA-C-O 122.019 0.914 . . . . 0.0 111.766 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp . . . . . 0 C--N 1.3 -1.583 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 -178.469 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.421 0 N-CA-C 110.964 -0.855 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -62.12 -50.56 4.7 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.726 2.284 . . . . 0.0 110.857 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.4 tp -95.56 130.99 42.23 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.11 -42.22 98.15 Favored Glycine 0 C--O 1.226 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.558 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.5 m -72.04 -25.26 61.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.414 0.626 . . . . 0.0 110.42 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 87.2 mtp 63.96 173.73 0.18 Allowed 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.881 -175.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.433 ' HB3' ' HG2' ' A' ' 71' ' ' LYS . 67.4 m -98.5 139.81 33.69 Favored 'General case' 0 N--CA 1.406 -2.657 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.239 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.1 p -144.73 135.14 24.37 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.084 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 21' ' ' THR . 69.0 t -106.19 125.63 61.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -81.05 117.31 21.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 124.185 0.928 . . . . 0.0 108.874 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.604 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -133.26 140.55 47.55 Favored 'General case' 0 C--N 1.29 -1.995 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -124.26 140.92 52.5 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.62 165.68 18.8 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 m -56.55 -37.36 70.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.812 0.815 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.92 -3.87 55.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.573 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -110.52 143.34 41.01 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.9 tp -94.99 -37.73 11.0 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.573 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -99.97 158.02 16.12 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.391 -0.523 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.65 137.14 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 116.07 -0.514 . . . . 0.0 112.039 -176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -95.31 174.7 6.91 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 171.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -138.34 133.91 33.58 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -175.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.3 m -94.9 114.92 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 171.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -90.21 114.41 26.39 Favored 'General case' 0 N--CA 1.41 -2.46 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.152 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 9' ' ' VAL . 5.5 p90 -135.83 165.39 25.73 Favored 'General case' 0 C--N 1.282 -2.327 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -177.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 6.01 32.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -174.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.48 -178.52 45.37 Favored Glycine 0 C--N 1.285 -2.25 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.577 177.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -89.78 -39.84 12.86 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.47 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.81 153.27 44.4 Favored 'General case' 0 CA--C 1.488 -1.437 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.045 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.0 tt -123.47 129.41 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.242 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.711 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -63.11 145.0 56.41 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.234 178.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.1 tp -54.99 -44.43 74.48 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.502 1.121 . . . . 0.0 112.981 -176.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.541 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.8 t -57.0 -45.58 82.9 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.148 0.499 . . . . 0.0 109.755 178.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.523 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 9.4 m-20 -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.146 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.77 95.96 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.04 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 54.7 mtmt -63.11 -41.55 99.38 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.252 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.61 -37.46 84.0 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.593 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -66.03 -50.23 64.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.083 0.468 . . . . 0.0 109.796 178.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.32 -43.36 91.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.632 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.7 mtm -66.02 -34.99 79.35 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.222 -0.191 . . . . 0.0 111.264 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.2 -39.98 51.12 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.496 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.47 -48.03 68.36 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 123.375 0.67 . . . . 0.0 112.151 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -91.49 2.11 56.66 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.316 -174.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.39 65.45 1.17 Allowed 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 124.444 1.098 . . . . 0.0 111.28 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -95.09 173.55 7.52 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.21 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.448 ' HG3' ' SG ' ' A' ' 49' ' ' CYS . 16.8 ptpt -105.95 101.33 10.83 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.334 178.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.92 -13.29 59.89 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.384 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.58 4.68 45.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.997 0.427 . . . . 0.0 111.211 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -124.72 -40.53 2.19 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.391 0.615 . . . . 0.0 109.464 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.448 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 24.4 p -134.03 164.35 27.52 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.963 -178.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -116.12 170.36 8.56 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.8 tp -115.43 123.71 49.3 Favored 'General case' 0 C--N 1.267 -3.019 0 CA-C-O 121.456 0.646 . . . . 0.0 109.283 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.491 ' HB2' HG12 ' A' ' 80' ' ' ILE . 5.1 tp-100 -103.4 123.94 47.78 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -177.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -116.79 127.83 74.32 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.3 m -115.73 146.89 41.5 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.525 ' HA ' HG13 ' A' ' 75' ' ' VAL . 13.8 t-20 -77.0 138.14 39.42 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.16 -21.42 46.48 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.683 0.754 . . . . 0.0 110.987 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -98.53 -56.23 2.52 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.927 -175.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.9 p -85.93 -19.65 30.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.553 0.692 . . . . 0.0 109.672 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.1 mmtp 63.45 21.07 12.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.914 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -77.89 129.51 35.46 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -93.62 127.82 39.49 Favored 'General case' 0 N--CA 1.416 -2.13 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -94.65 96.0 9.13 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -92.54 -21.14 20.28 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.025 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.631 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 12.8 m-20 -97.92 133.35 42.52 Favored 'General case' 0 CA--C 1.492 -1.275 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.412 ' HA ' HD22 ' A' ' 31' ' ' LEU . 3.1 p30 -73.39 -4.07 31.22 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -175.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.631 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 6.9 p30 -85.35 -10.05 56.83 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.043 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.0 146.11 48.28 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.47 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.45 137.42 52.52 Favored 'General case' 0 C--N 1.289 -2.041 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.328 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.65 114.44 39.92 Favored Pre-proline 0 N--CA 1.435 -1.193 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.065 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 72.0 Cg_endo -78.89 156.67 27.16 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.166 2.577 . . . . 0.0 112.389 176.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.62 -7.48 33.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.925 0.869 . . . . 0.0 111.811 178.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -83.43 -11.88 57.04 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.39 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.9 m -112.58 152.25 29.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 120.888 0.375 . . . . 0.0 111.366 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.9 m -109.9 132.42 54.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 173.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.8 m -127.39 160.52 36.37 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -175.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.1 mm -112.29 132.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.0 t -109.24 129.71 63.51 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 CA-C-O 121.086 0.47 . . . . 0.0 110.789 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.405 ' HB3' ' HB3' ' A' ' 52' ' ' GLN . 29.4 ttm180 -126.61 152.26 46.88 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 125.225 1.41 . . . . 0.0 107.744 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -110.24 127.74 55.14 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.491 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.9 pp -132.59 161.58 62.43 Favored Pre-proline 0 C--O 1.21 -0.995 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.693 -175.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.89 138.16 47.43 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 122.362 2.041 . . . . 0.0 112.12 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.432 HG21 ' C ' ' A' ' 49' ' ' CYS . 4.9 pt -61.3 -36.12 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 155.75 -67.13 0.3 Allowed Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 118.916 -1.611 . . . . 0.0 112.608 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.71 -42.12 7.92 Favored Glycine 0 CA--C 1.484 -1.89 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.45 90.56 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 86' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--N 1.292 -1.923 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.55 -178.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.554 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -79.67 54.6 5.27 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 123.65 2.9 . . . . 0.0 112.636 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -85.9 -5.84 59.17 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.57 30.49 5.29 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.582 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.6 t -149.62 24.03 0.88 Allowed 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 92.8 mmm 58.85 113.13 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 125.112 1.365 . . . . 0.0 112.931 -173.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 46.0 m -74.32 120.68 20.22 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.781 -176.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.624 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.6 p -147.78 142.41 26.6 Favored 'General case' 0 N--CA 1.422 -1.826 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.608 -175.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.427 HG22 ' CE1' ' A' ' 24' ' ' PHE . 87.8 t -107.18 136.55 41.87 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 178.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -83.32 109.54 17.36 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.572 ' CE1' HG12 ' A' ' 22' ' ' VAL . 30.9 p90 -124.81 140.2 53.14 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 19' ' ' TYR . 63.8 pttt -125.68 123.2 38.38 Favored 'General case' 0 C--N 1.293 -1.872 0 C-N-CA 118.443 -1.303 . . . . 0.0 110.956 174.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.541 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 1.4 t80 -84.34 172.44 11.79 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.276 -176.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -64.13 -27.0 68.78 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.563 0.697 . . . . 0.0 109.232 170.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.7 m -82.57 -20.32 36.77 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.338 178.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.482 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 0.9 OUTLIER -111.65 101.46 9.85 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.672 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.76 -33.27 75.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.592 0.71 . . . . 0.0 110.646 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -114.36 169.19 9.22 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.633 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.407 ' HA ' ' HB3' ' A' ' 12' ' ' LYS . 98.5 m-85 -70.5 147.64 49.15 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -121.88 177.35 5.33 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 104.615 -2.365 . . . . 0.0 104.615 176.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.8 p -135.64 127.19 28.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -95.97 114.95 33.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.574 171.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' A' ' 7' ' ' SER . 2.2 p -85.47 124.86 32.54 Favored 'General case' 0 N--CA 1.418 -2.045 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.512 ' O ' ' HB2' ' A' ' 7' ' ' SER . 38.5 p90 -142.28 176.68 8.8 Favored 'General case' 0 N--CA 1.434 -1.266 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -105.35 136.66 44.48 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.687 0.279 . . . . 0.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.95 -147.74 18.5 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.533 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.33 -39.8 4.32 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.462 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -138.75 157.86 45.3 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.432 -179.069 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -128.35 129.43 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.092 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.336 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.8 m -61.66 148.08 43.76 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.054 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.426 HD22 ' O ' ' A' ' 64' ' ' ASP . 51.7 tp -57.48 -41.53 80.87 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 124.186 0.994 . . . . 0.0 112.547 -176.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.667 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 48.0 t -55.61 -46.47 77.33 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.498 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 4.5 m-20 -69.88 -42.57 73.27 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.28 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 124.03 0.932 . . . . 0.0 110.361 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.9 mtmt -67.19 -38.3 85.15 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.566 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.667 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 1.6 mptm? -61.39 -36.57 80.64 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -64.4 -50.09 69.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 109.491 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.2 mt -73.01 -41.4 59.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.471 -174.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.4 mtt -59.94 -44.43 94.37 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 110.455 -0.202 . . . . 0.0 110.455 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.78 -33.7 71.29 Favored Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.727 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -71.92 -46.44 57.61 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -91.5 -1.5 57.51 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 120.858 0.361 . . . . 0.0 111.943 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.407 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 26.4 mmtm 66.93 66.96 0.42 Allowed 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 125.08 1.352 . . . . 0.0 110.363 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.81 170.01 9.61 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -112.46 101.72 9.87 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.099 175.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.15 -6.6 59.54 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.364 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.94 -3.97 53.56 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.389 0.614 . . . . 0.0 110.171 177.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.412 ' C ' HG12 ' A' ' 82' ' ' ILE . 31.8 t70 -128.68 -30.3 2.31 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.58 0.705 . . . . 0.0 111.486 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.6 m -132.06 157.24 44.67 Favored 'General case' 0 N--CA 1.414 -2.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.38 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.563 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 37.5 t0 -120.01 162.19 19.66 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 53' ' ' ILE . 21.3 tp -108.92 108.13 18.77 Favored 'General case' 0 C--N 1.257 -3.429 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 -177.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.426 ' CA ' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -97.53 116.66 30.17 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-O 121.693 0.759 . . . . 0.0 109.249 -174.813 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.453 ' CD1' HG11 ' A' ' 77' ' ' VAL . 21.2 mm -105.26 130.52 56.36 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.757 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 m -125.02 141.59 52.03 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.59 128.9 38.51 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 122.594 0.357 . . . . 0.0 110.955 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.87 -29.51 65.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.24 0.543 . . . . 0.0 110.341 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -87.78 -58.11 2.69 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.862 -177.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.4 p -90.64 -14.28 32.66 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -171.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.17 21.69 12.98 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 123.344 0.658 . . . . 0.0 112.769 -172.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -74.74 121.87 22.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -92.31 119.54 31.99 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.471 ' CZ ' HG13 ' A' ' 69' ' ' ILE . 87.7 m-85 -55.72 -65.29 0.62 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 123.645 0.778 . . . . 0.0 112.416 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.8 p 74.41 -36.8 0.34 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 127.802 2.441 . . . . 0.0 114.631 171.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' HD22 ' A' ' 31' ' ' LEU . 4.6 t70 -95.49 132.88 40.12 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -174.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.49 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 9.5 m-20 -65.27 -14.18 60.14 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.24 0.543 . . . . 0.0 111.703 -175.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -91.97 -1.97 56.99 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.48 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.49 145.1 47.76 Favored 'General case' 0 C--O 1.194 -1.836 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.462 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.53 138.32 51.98 Favored 'General case' 0 C--N 1.288 -2.104 0 CA-C-N 118.825 0.739 . . . . 0.0 111.399 -173.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.471 HG13 ' CZ ' ' A' ' 62' ' ' TYR . 3.2 mp -114.06 115.51 45.5 Favored Pre-proline 0 C--N 1.312 -1.042 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.448 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 92.3 Cg_endo -81.11 159.62 20.57 Favored 'Trans proline' 0 C--N 1.324 -0.761 0 C-N-CA 123.116 2.544 . . . . 0.0 113.479 175.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -73.35 4.83 4.18 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.966 176.049 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -87.54 -19.07 28.39 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.0 m -109.63 162.31 14.55 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.625 0.726 . . . . 0.0 112.765 -173.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.4 m -121.51 130.56 53.62 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.6 m -129.01 158.79 41.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.4 mm -99.69 129.17 50.68 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 59.9 t -109.74 111.48 36.33 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 CA-C-O 121.556 0.693 . . . . 0.0 109.46 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.0 ttp-105 -121.23 136.34 54.99 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.824 -174.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -93.08 128.35 38.95 Favored 'General case' 0 C--N 1.292 -1.899 0 O-C-N 121.954 -0.466 . . . . 0.0 110.216 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pp -125.72 152.37 72.16 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 144.92 17.09 Favored 'Trans proline' 0 C--N 1.326 -0.649 0 C-N-CA 122.153 1.902 . . . . 0.0 111.117 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.563 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 29.3 pt -95.92 -39.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 C-N-CA 119.306 -0.957 . . . . 0.0 111.434 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.26 50.6 64.87 Favored Glycine 0 N--CA 1.442 -0.932 0 O-C-N 123.764 0.665 . . . . 0.0 111.54 -177.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -95.32 57.3 1.71 Allowed Glycine 0 N--CA 1.421 -2.319 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.2 t -78.6 90.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.387 0 CA-C-O 121.628 0.727 . . . . 0.0 109.929 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? . . . . . 0 C--N 1.282 -2.349 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.764 177.048 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.406 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.72 2.84 5.44 Favored 'Trans proline' 0 C--N 1.365 1.401 0 C-N-CA 123.531 2.821 . . . . 0.0 111.7 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -146.71 155.71 42.62 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -117.48 24.53 9.08 Favored Glycine 0 C--N 1.298 -1.534 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m -79.74 -2.91 45.19 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -175.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.9 mtp -119.24 152.05 37.34 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.516 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 49.5 m -134.65 133.17 39.8 Favored 'General case' 0 C--N 1.274 -2.68 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.411 -174.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.3 p -145.01 141.77 29.21 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.007 -178.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG22 ' CE1' ' A' ' 24' ' ' PHE . 87.2 t -107.02 129.9 59.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -80.61 110.85 16.49 Favored 'General case' 0 CA--C 1.491 -1.293 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 174.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.595 ' OH ' ' HG2' ' A' ' 41' ' ' ARG . 37.6 p90 -131.9 146.37 52.07 Favored 'General case' 0 C--N 1.28 -2.449 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -130.55 141.98 50.47 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -89.81 169.35 11.34 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.2 m -56.93 -37.01 70.89 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.999 0.428 . . . . 0.0 111.297 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.7 m -90.99 4.02 53.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -117.62 125.93 51.62 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.0 tt -83.26 -42.0 17.7 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.2 157.81 20.53 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -88.44 146.78 25.03 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 120.964 0.411 . . . . 0.0 110.698 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -112.06 174.76 5.73 Favored 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 p -139.37 115.71 10.5 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.144 0.497 . . . . 0.0 111.238 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.8 p -95.86 120.85 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.082 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 177.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.0 p -87.95 140.24 29.7 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.449 ' CE1' HG22 ' A' ' 9' ' ' VAL . 33.8 p90 -151.94 170.89 18.75 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -178.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -102.45 138.29 39.57 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.09 -173.91 17.06 Favored Glycine 0 N--CA 1.433 -1.509 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -88.66 -31.32 18.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.537 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -147.69 157.5 43.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -175.417 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 tt -121.73 128.5 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.247 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 16.3 m -63.79 147.09 52.65 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.223 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.2 tp -57.81 -42.77 84.97 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 124.019 0.927 . . . . 0.0 112.419 -176.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -54.25 -45.17 72.33 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.609 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 19.2 m-20 -68.23 -49.69 59.01 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.463 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.2 -45.47 91.0 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.822 -1.081 . . . . 0.0 112.746 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HA ' HD21 ' A' ' 51' ' ' LEU . 51.9 mtmt -63.05 -41.49 99.49 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.785 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.3 mptp? -61.58 -38.48 87.68 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 120.664 0.268 . . . . 0.0 110.373 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 15.4 mm100 -68.15 -50.15 56.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.69 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.8 mt -70.47 -39.07 75.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.7 mtm -64.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.967 178.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.36 -35.53 56.29 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.449 175.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.595 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 25.3 tpt180 -61.06 -51.17 70.31 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.197 0.999 . . . . 0.0 111.9 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.38 -1.12 54.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.86 0.362 . . . . 0.0 111.856 -176.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm 66.22 68.5 0.44 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 125.092 1.357 . . . . 0.0 110.48 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -95.52 158.22 15.55 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.793 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' HD3' ' HB2' ' A' ' 48' ' ' ASP . 8.1 ptpp? -85.1 101.04 12.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 170.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.72 -7.49 59.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -169.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.22 -12.85 17.7 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.705 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.41 ' HB2' ' HD3' ' A' ' 45' ' ' LYS . 4.0 m-20 -105.93 -16.5 14.62 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -175.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -148.03 170.29 18.07 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.469 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 28.4 t70 -120.94 164.9 16.0 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 35' ' ' LYS . 19.5 tp -116.27 113.62 23.24 Favored 'General case' 0 N--CA 1.405 -2.724 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.469 ' HB2' HG12 ' A' ' 80' ' ' ILE . 33.8 tt0 -111.13 112.0 23.49 Favored 'General case' 0 C--N 1.281 -2.402 0 CA-C-O 121.781 0.801 . . . . 0.0 109.23 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.425 ' CD1' HG12 ' A' ' 77' ' ' VAL . 29.0 mm -90.53 135.77 25.68 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.48 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.663 -172.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 14.9 m -117.88 145.33 44.7 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.561 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.4 t-20 -74.73 141.98 44.42 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -84.97 -27.52 26.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.715 0.769 . . . . 0.0 110.62 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -85.03 -48.68 8.99 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.559 -175.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -98.1 -20.27 17.45 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.252 0.548 . . . . 0.0 110.076 -176.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 60.79 36.96 19.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.675 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -101.27 132.57 46.72 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 1.1 mp0 -81.69 148.11 29.16 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-O 121.878 0.847 . . . . 0.0 112.36 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -108.14 101.11 10.37 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 173.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.8 p -97.97 -27.26 14.33 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.286 0.565 . . . . 0.0 112.013 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -91.01 128.46 36.84 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -177.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -66.96 -6.26 16.05 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -95.32 1.77 54.52 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.749 178.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.53 152.72 43.67 Favored 'General case' 0 C--O 1.207 -1.182 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 173.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.537 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.83 138.29 52.82 Favored 'General case' 0 C--N 1.289 -2.031 0 O-C-N 121.77 -0.581 . . . . 0.0 111.473 -178.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.49 117.16 38.55 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.223 175.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.449 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 74.0 Cg_endo -80.21 161.17 23.21 Favored 'Trans proline' 0 C--N 1.328 -0.523 0 C-N-CA 123.522 2.815 . . . . 0.0 114.064 177.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.516 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 47.4 pttt -67.62 -16.37 64.13 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.222 176.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -70.87 -25.64 62.89 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.796 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.8 m -98.32 159.68 14.79 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-O 121.639 0.733 . . . . 0.0 112.17 -173.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.9 m -124.01 127.87 48.54 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 173.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.501 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 21.9 m -125.38 155.0 34.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 CA-C-O 121.593 0.711 . . . . 0.0 112.8 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.4 mm -104.16 127.84 58.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.425 HG12 ' CD1' ' A' ' 53' ' ' ILE . 60.0 t -99.46 111.58 29.46 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.519 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.359 -175.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -110.55 130.93 55.45 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.889 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -89.75 127.55 35.97 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.469 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.85 150.11 55.04 Favored Pre-proline 0 C--N 1.305 -1.364 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.085 -178.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.51 137.92 18.97 Favored 'Trans proline' 0 N--CA 1.448 -1.165 0 C-N-CA 122.063 1.842 . . . . 0.0 112.196 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.469 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 36.6 pt -89.7 -21.1 6.86 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 127.58 -56.31 0.73 Allowed Glycine 0 N--CA 1.424 -2.14 0 N-CA-C 108.288 -1.925 . . . . 0.0 108.288 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 142.05 52.3 0.04 OUTLIER Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.09 91.12 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.161 0 CA-C-O 121.733 0.777 . . . . 0.0 111.071 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.48 ' HD2' ' OXT' ' A' ' 86' ' ' LYS . 1.6 pptp? . . . . . 0 N--CA 1.408 -2.543 0 CA-C-N 113.822 -1.535 . . . . 0.0 107.293 175.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.306 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -66.35 -24.96 49.56 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.725 2.283 . . . . 0.0 112.647 -178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -100.83 12.41 37.63 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.99 55.66 1.84 Allowed Glycine 0 N--CA 1.43 -1.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.493 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 m 64.35 15.58 9.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.56 1.144 . . . . 0.0 112.998 176.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 41.3 mtm -109.84 157.69 18.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.487 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.1 m -98.84 128.53 45.07 Favored 'General case' 0 N--CA 1.414 -2.264 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.5 p -127.29 128.61 46.25 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.075 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.484 ' CG2' ' HA ' ' A' ' 71' ' ' LYS . 41.2 t -106.93 131.05 57.88 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -86.64 112.7 21.86 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.1 p90 -126.2 133.23 51.59 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.867 -177.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -118.35 135.74 54.14 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.134 -1.026 . . . . 0.0 108.962 175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.513 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 1.2 t80 -92.52 165.34 13.07 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -176.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -56.86 -31.95 65.32 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.45 0.643 . . . . 0.0 109.799 175.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.5 m -82.68 -8.73 59.58 Favored 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.959 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' HD2' ' H ' ' A' ' 13' ' ' PHE . 65.5 mttm -108.66 146.33 33.6 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 121.928 -0.483 . . . . 0.0 110.72 -177.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.4 tp -92.65 -46.19 7.71 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 171.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -97.24 155.87 16.67 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.778 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -75.8 135.96 40.25 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 121.305 0.574 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -94.74 177.85 5.78 Favored 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -137.48 128.11 26.85 Favored 'General case' 0 C--N 1.28 -2.44 0 CA-C-N 118.432 0.56 . . . . 0.0 111.462 -174.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -113.22 136.28 50.07 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.0 p -112.28 138.76 48.52 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 120.849 0.357 . . . . 0.0 111.517 -178.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -151.57 176.3 11.48 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.69 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -103.82 150.11 24.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 175.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.07 161.52 34.19 Favored Glycine 0 C--N 1.303 -1.296 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 tt -71.88 -32.79 67.79 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 118.074 0.937 . . . . 0.0 108.841 -177.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.499 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -138.5 159.8 41.16 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.369 -176.142 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.8 tt -128.66 128.15 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.593 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -56.83 142.27 41.53 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.893 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.2 tp -58.23 -34.77 70.8 Favored 'General case' 0 N--CA 1.419 -1.994 0 C-N-CA 124.738 1.215 . . . . 0.0 110.727 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.694 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 11.7 t -58.36 -46.49 86.2 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -74.42 -41.46 60.84 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.613 -176.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.0 -47.34 85.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.001 1.32 . . . . 0.0 111.275 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.5 mtmt -67.05 -43.29 83.08 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 120.535 0.207 . . . . 0.0 111.021 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.92 -35.19 77.67 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.83 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.03 -49.95 72.62 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 120.881 0.372 . . . . 0.0 110.152 175.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.8 mt -69.17 -44.85 80.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.739 -175.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 73.8 mtm -66.05 -39.89 90.49 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.238 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.24 -37.11 86.22 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.038 -1.077 . . . . 0.0 111.221 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -65.43 -49.03 70.69 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 123.065 0.546 . . . . 0.0 111.836 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 46.5 mt-10 -103.34 19.6 19.36 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.8 mmtt 62.16 34.11 16.44 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.676 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 7.8 mp -71.96 132.77 44.77 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.068 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.427 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 16.4 ptpt -71.86 101.4 2.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 122.144 0.973 . . . . 0.0 111.293 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.71 -7.91 57.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.896 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.83 -0.4 45.23 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.574 0.702 . . . . 0.0 110.349 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.427 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 9.3 t70 -113.05 -41.18 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.032 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -133.34 166.7 21.89 Favored 'General case' 0 N--CA 1.415 -2.225 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.459 -174.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -116.86 166.66 11.9 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.473 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 14.2 tp -112.79 125.45 54.36 Favored 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.501 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -111.52 109.04 18.77 Favored 'General case' 0 C--N 1.284 -2.277 0 O-C-N 121.777 -0.577 . . . . 0.0 109.709 -177.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.44 ' CD1' ' HG ' ' A' ' 51' ' ' LEU . 1.9 mp -99.69 125.65 53.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 CA-C-O 121.388 0.613 . . . . 0.0 110.084 -176.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.9 m -115.22 137.1 52.39 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.578 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.7 t-20 -67.15 138.24 56.89 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.76 -20.82 41.83 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.499 0.666 . . . . 0.0 111.263 -177.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -98.83 -47.33 5.33 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.384 -174.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 42.8 p -95.15 -22.59 17.76 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.4 0.619 . . . . 0.0 109.938 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.578 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 69.68 21.58 6.51 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 125.394 1.478 . . . . 0.0 111.538 -175.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.52 119.53 12.47 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.669 -1.151 . . . . 0.0 108.419 176.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -90.16 121.02 31.82 Favored 'General case' 0 N--CA 1.411 -2.386 0 CA-C-O 121.522 0.677 . . . . 0.0 110.889 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -93.21 100.77 13.08 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -100.64 -22.34 14.96 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.768 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -99.94 137.87 37.79 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.1 m-20 -60.03 -19.55 53.26 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -78.4 -8.73 58.8 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.9 152.16 45.1 Favored 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.4 138.6 52.98 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 118.604 0.638 . . . . 0.0 112.516 -176.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.21 115.23 38.28 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.57 173.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 47.3 Cg_endo -77.76 151.39 28.15 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.991 2.46 . . . . 0.0 113.016 174.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.484 ' HA ' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -67.18 -10.87 54.79 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.973 0.892 . . . . 0.0 113.294 -177.714 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -87.18 -4.77 59.13 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.875 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.6 m -109.73 143.15 39.92 Favored 'General case' 0 N--CA 1.426 -1.648 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.1 m -103.58 129.08 50.75 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 55' ' ' ASN . 29.5 m -124.45 159.59 30.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -174.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -101.39 134.49 41.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.1 t -114.58 114.44 46.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 CA-C-O 121.053 0.454 . . . . 0.0 109.784 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -113.62 132.29 55.81 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.613 -177.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -85.96 121.88 29.22 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.501 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -123.25 147.99 53.67 Favored Pre-proline 0 C--O 1.206 -1.221 0 C-N-CA 120.551 -0.46 . . . . 0.0 109.916 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.31 138.13 38.48 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 121.989 1.793 . . . . 0.0 111.255 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 85' ' ' VAL . 16.7 pt -71.14 -38.48 71.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.346 176.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.4 ' N ' HG13 ' A' ' 82' ' ' ILE . . . 69.3 -69.47 0.5 Allowed Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.641 -176.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -143.11 -5.55 0.72 Allowed Glycine 0 N--CA 1.418 -2.532 0 CA-C-N 114.79 -0.705 . . . . 0.0 112.267 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 82' ' ' ILE . 27.1 m -80.11 95.92 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-O 122.379 1.085 . . . . 0.0 111.528 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 C--N 1.296 -1.72 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.05 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.773 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' HB2' ' A' ' 5' ' ' SER . 13.7 Cg_exo -71.86 128.91 14.68 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.918 2.412 . . . . 0.0 111.377 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.36 -63.22 1.45 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 120.951 0.405 . . . . 0.0 111.257 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.77 5.52 84.81 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 113.911 -173.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.415 ' HB2' ' HB2' ' A' ' 2' ' ' PRO . 56.7 m -94.23 5.08 52.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.449 -0.501 . . . . 0.0 112.113 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 97.0 mmm -68.92 136.65 52.91 Favored 'General case' 0 CA--C 1.495 -1.165 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 18.0 m -80.97 110.63 16.69 Favored 'General case' 0 N--CA 1.402 -2.851 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.113 -171.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -138.69 129.04 25.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.091 -177.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 21' ' ' THR . 51.3 t -107.23 132.12 55.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.518 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 49.4 m-70 -80.8 108.83 14.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.57 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 32.8 p90 -124.37 137.48 54.46 Favored 'General case' 0 C--N 1.281 -2.373 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -120.32 133.29 55.48 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 174.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -88.88 153.71 20.83 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 -177.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.2 p -68.45 -12.45 61.21 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.383 0.611 . . . . 0.0 111.484 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.9 p -87.78 -9.72 53.11 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.307 0.575 . . . . 0.0 109.884 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -113.66 -176.96 3.02 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.3 tp -134.23 -20.69 1.88 Allowed 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.346 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -104.77 157.37 17.24 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.23 147.68 27.86 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.455 175.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.518 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 6.9 t70 -123.43 178.69 5.04 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 5.6 p -130.05 115.41 17.06 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 118.551 0.614 . . . . 0.0 110.916 -173.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.57 ' HB ' ' CE1' ' A' ' 11' ' ' TYR . 10.0 p -95.54 135.62 29.08 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.018 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 7' ' ' SER . 10.0 p -105.46 146.04 30.04 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -174.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 7' ' ' SER . 24.5 p90 -156.51 176.44 12.7 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -113.06 135.0 54.27 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 173.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.53 177.43 16.32 Favored Glycine 0 N--CA 1.425 -2.04 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -81.47 -32.41 32.54 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.623 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -148.99 160.08 43.64 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.973 -175.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.4 tt -126.24 128.01 71.22 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.008 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.8 m -61.94 147.93 45.28 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.35 0.66 . . . . 0.0 111.093 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 43.5 tp -54.67 -46.34 74.01 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.48 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -56.05 -45.31 79.26 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 120.969 0.414 . . . . 0.0 109.959 179.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.04 -41.23 82.39 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.611 0.719 . . . . 0.0 111.073 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.8 -46.8 87.95 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.555 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' HD22 ' A' ' 51' ' ' LEU . 57.9 mtmt -66.11 -39.39 89.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.828 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.7 mptp? -61.63 -39.38 91.1 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.227 0.329 . . . . 0.0 111.488 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -66.62 -47.69 71.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.273 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.11 -47.39 78.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.4 mtm -64.72 -38.26 90.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.908 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.55 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.925 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -71.92 -50.14 31.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.079 0.466 . . . . 0.0 111.327 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.32 -9.75 58.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.486 -173.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm 71.71 62.29 0.15 Allowed 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 125.316 1.446 . . . . 0.0 110.564 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.03 158.36 15.59 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.044 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -106.83 104.41 14.09 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 122.171 0.986 . . . . 0.0 109.706 176.844 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.65 61.8 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.158 -176.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.49 58.09 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.188 0.518 . . . . 0.0 110.782 178.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.469 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 19.2 t70 -117.04 -39.61 3.21 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.727 0.775 . . . . 0.0 110.102 178.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.5 p -138.8 160.81 38.78 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.833 -174.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -115.31 167.39 10.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 35' ' ' LYS . 20.0 tp -114.57 109.82 18.85 Favored 'General case' 0 N--CA 1.404 -2.747 0 CA-C-O 121.502 0.668 . . . . 0.0 109.62 -174.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.482 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.0 tt0 -94.15 120.78 34.88 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -176.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -109.02 130.87 61.21 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.472 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -176.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.8 m -120.38 147.54 44.92 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.6 t-20 -78.33 138.67 38.68 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.07 37.77 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.444 0.64 . . . . 0.0 110.933 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -95.79 -51.89 4.31 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.594 -173.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -89.73 -18.27 26.68 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.524 0.678 . . . . 0.0 109.789 -176.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.6 mmmt 65.4 24.13 12.01 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.078 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -84.75 129.45 34.82 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -85.87 127.42 34.58 Favored 'General case' 0 N--CA 1.417 -2.086 0 CA-C-O 121.626 0.727 . . . . 0.0 109.716 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.14 93.91 8.25 Favored 'General case' 0 C--N 1.272 -2.765 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.074 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -88.36 -28.35 21.03 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.342 -1.299 . . . . 0.0 113.446 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' HB3' HD21 ' A' ' 66' ' ' ASN . 3.6 t70 -99.9 146.08 27.07 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -178.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.34 -5.95 42.98 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.407 HD21 ' HB3' ' A' ' 64' ' ' ASP . 1.0 OUTLIER -85.5 -11.76 53.42 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.888 179.149 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 31' ' ' LEU . . . -60.71 114.08 2.82 Favored 'General case' 0 C--O 1.203 -1.345 0 O-C-N 124.074 0.859 . . . . 0.0 111.298 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.623 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -91.6 138.65 31.4 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.443 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.73 115.6 43.78 Favored Pre-proline 0 C--N 1.301 -1.5 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.669 173.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.432 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 71.6 Cg_endo -79.57 158.5 25.31 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.449 2.766 . . . . 0.0 113.232 176.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -68.48 -4.33 14.6 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.617 178.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -86.74 -11.09 52.12 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.209 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.6 m -118.71 154.33 32.93 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 m -109.37 131.76 54.77 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.43 HG11 ' HA ' ' A' ' 55' ' ' ASN . 19.0 m -126.11 157.44 36.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-O 121.854 0.835 . . . . 0.0 112.882 -175.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mm -99.23 127.25 52.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.3 t -108.45 114.31 46.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.382 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -118.4 138.64 52.31 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.566 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -93.33 122.92 36.24 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.482 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -124.08 153.8 68.05 Favored Pre-proline 0 C--N 1.31 -1.149 0 O-C-N 122.195 -0.315 . . . . 0.0 110.596 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.61 136.2 30.19 Favored 'Trans proline' 0 C--N 1.323 -0.776 0 C-N-CA 121.828 1.685 . . . . 0.0 111.199 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.1 pt -72.62 -22.18 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.016 0.436 . . . . 0.0 109.875 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 105.35 -34.06 6.07 Favored Glycine 0 N--CA 1.426 -1.972 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.37 -58.81 0.39 Allowed Glycine 0 CA--C 1.482 -2.011 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -177.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.12 124.76 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 172.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 93.4 mttt . . . . . 0 C--N 1.29 -1.999 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.86 -175.573 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.832 0 N-CA-C 110.406 -1.077 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -82.67 158.85 16.48 Favored 'Trans proline' 0 N--CA 1.436 -1.91 0 C-N-CA 122.303 2.002 . . . . 0.0 112.405 -176.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp -111.46 11.24 21.4 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.42 63.89 2.17 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.163 -1.575 . . . . 0.0 109.163 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.0 p -69.49 -24.49 63.77 Favored 'General case' 0 CA--C 1.495 -1.168 0 CA-C-O 121.39 0.614 . . . . 0.0 112.477 -175.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.4 mtp -91.08 86.76 6.32 Favored 'General case' 0 C--N 1.285 -2.235 0 CA-C-O 122.62 1.2 . . . . 0.0 108.137 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.3 m -87.68 122.06 30.89 Favored 'General case' 0 C--N 1.255 -3.506 0 CA-C-N 113.304 -1.771 . . . . 0.0 106.802 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.1 p -133.39 134.6 43.9 Favored 'General case' 0 C--N 1.294 -1.829 0 C-N-CA 120.22 -0.592 . . . . 0.0 111.41 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.0 t -107.32 123.42 62.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.861 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -78.3 114.36 17.12 Favored 'General case' 0 N--CA 1.419 -2.001 0 O-C-N 124.152 0.907 . . . . 0.0 108.907 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.507 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 50.0 p90 -125.05 131.94 53.28 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -117.37 131.22 56.82 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 118.404 -1.318 . . . . 0.0 109.304 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.444 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -86.17 156.68 20.23 Favored 'General case' 0 C--N 1.273 -2.748 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -177.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.3 p -60.26 -27.79 67.53 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.243 0.544 . . . . 0.0 110.527 175.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.6 m -96.78 8.43 44.33 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.703 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.444 ' HD3' ' CB ' ' A' ' 13' ' ' PHE . 5.9 mptp? -108.69 157.16 18.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.11 -34.24 13.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.197 0.522 . . . . 0.0 110.52 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -133.37 175.98 8.93 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -77.11 141.82 40.03 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.336 0.589 . . . . 0.0 111.38 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -108.33 177.31 4.83 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 p -136.79 136.47 38.88 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -175.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -98.72 122.27 50.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 167.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.0 p -93.86 123.54 37.28 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -140.94 177.36 8.1 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -120.27 118.59 30.84 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.461 0.573 . . . . 0.0 112.355 -175.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 134.69 -113.89 1.2 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.86 174.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -131.48 -45.23 0.99 Allowed 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.599 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -141.18 161.66 37.35 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -125.16 127.75 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.133 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.8 m -58.83 137.92 57.51 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.525 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.42 HD13 ' CG1' ' A' ' 53' ' ' ILE . 53.2 tp -54.79 -41.7 70.88 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 124.432 1.093 . . . . 0.0 112.672 -175.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 8.1 t -57.42 -45.42 84.64 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.2 t70 -66.41 -42.36 87.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -64.94 -46.87 79.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.883 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 41.3 mtmt -69.04 -37.89 78.84 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.813 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.7 mptt -61.84 -39.49 92.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.003 177.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 74.7 mt-30 -64.02 -50.88 66.71 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.018 177.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.79 -46.59 96.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.854 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.3 mtm -64.92 -38.34 90.63 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.879 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.86 -33.31 57.84 Favored Glycine 0 C--N 1.315 -0.636 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.156 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -72.96 -48.49 36.26 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 123.463 0.705 . . . . 0.0 112.013 -177.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -95.47 -0.45 52.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.166 0.508 . . . . 0.0 112.125 -173.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 44.5 mmtt 67.35 68.23 0.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.904 177.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.1 170.74 8.7 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.075 178.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -109.88 101.7 10.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.501 0.667 . . . . 0.0 110.106 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.15 -9.04 59.87 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 123.683 0.793 . . . . 0.0 111.271 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.3 -5.63 54.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.475 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.8 t70 -131.54 -29.82 1.72 Allowed 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.06 0.933 . . . . 0.0 110.814 -176.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.5 m -130.01 159.35 36.96 Favored 'General case' 0 N--CA 1.399 -3.004 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -176.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.621 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 5.7 t0 -118.36 169.56 9.64 Favored 'General case' 0 C--N 1.287 -2.119 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 175.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.483 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 24.0 tp -114.15 119.02 35.68 Favored 'General case' 0 C--N 1.248 -3.812 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.44 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.5 tt0 -113.22 117.2 31.21 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 -175.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.42 ' CG1' HD13 ' A' ' 31' ' ' LEU . 39.2 mm -99.91 135.55 35.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.695 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -176.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 m -123.65 145.36 49.01 Favored 'General case' 0 C--N 1.287 -2.145 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.474 ' HA ' HG11 ' A' ' 75' ' ' VAL . 14.3 t-20 -71.17 139.29 50.14 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.766 -0.584 . . . . 0.0 109.915 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.22 56.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.921 0.391 . . . . 0.0 111.336 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -94.69 -48.29 6.13 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.69 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.2 p -95.31 -19.24 20.14 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.769 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 59.58 41.62 18.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -94.94 126.63 40.4 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -80.87 135.42 35.92 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-O 120.848 0.356 . . . . 0.0 110.238 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -94.0 100.45 12.58 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -83.2 -47.32 11.69 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.682 -1.145 . . . . 0.0 114.06 -170.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -90.97 147.48 23.07 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -78.11 -1.43 32.45 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.298 0.57 . . . . 0.0 112.306 -176.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -92.79 -2.43 55.96 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.943 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.55 148.64 51.39 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 174.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.599 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -118.91 138.76 52.54 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 118.237 0.471 . . . . 0.0 111.634 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.26 117.25 36.81 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.239 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 73.4 Cg_endo -78.34 154.43 28.2 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 123.779 2.986 . . . . 0.0 114.514 177.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -65.05 -10.52 30.69 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.397 1.079 . . . . 0.0 111.776 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.57 -10.46 51.5 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.049 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.9 m -107.57 155.37 20.19 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.291 0.567 . . . . 0.0 111.435 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -118.85 132.91 56.13 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 173.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.507 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 18.8 m -128.64 162.38 35.64 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -104.45 132.84 50.12 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.437 ' CG1' HD12 ' A' ' 51' ' ' LEU . 42.8 t -106.46 113.96 44.43 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.178 0 CA-C-O 121.206 0.526 . . . . 0.0 110.015 -178.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 24.8 tpp180 -110.38 125.11 52.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.102 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -90.28 120.21 31.23 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 174.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.44 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.03 152.25 50.08 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.683 -176.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -76.8 140.85 21.08 Favored 'Trans proline' 0 C--O 1.245 0.856 0 C-N-CA 122.212 1.941 . . . . 0.0 111.053 176.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.621 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.9 pt -95.07 -32.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.51 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.91 -25.0 1.53 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 -173.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.541 ' H ' ' C ' ' A' ' 82' ' ' ILE . . . 108.49 5.29 32.08 Favored Glycine 0 N--CA 1.415 -2.701 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -176.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.42 86.97 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.249 1.037 0 CA-C-O 121.805 0.812 . . . . 0.0 111.794 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--N 1.299 -1.6 0 N-CA-C 106.44 -1.689 . . . . 0.0 106.44 176.768 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.737 0 N-CA-C 110.459 -1.057 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.53 -70.76 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.662 2.242 . . . . 0.0 111.875 -178.293 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 81.9 mt -125.91 155.51 41.15 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.39 48.04 20.12 Favored Glycine 0 N--CA 1.442 -0.929 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -175.432 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.1 m -144.83 35.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.042 -0.579 . . . . 0.0 109.748 -176.327 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.24 149.35 45.74 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.924 0.869 . . . . 0.0 112.214 178.071 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -102.71 127.17 49.95 Favored 'General case' 0 C--N 1.28 -2.442 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.94 -175.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.6 p -137.36 138.9 40.4 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.528 -179.297 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 21' ' ' THR . 41.5 t -107.38 134.98 47.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.467 -179.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -82.95 109.68 17.27 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 174.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.413 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.6 p90 -122.5 134.4 54.57 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -115.74 132.11 56.73 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 117.744 -1.583 . . . . 0.0 109.174 175.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.31 155.65 17.4 Favored 'General case' 0 C--N 1.275 -2.645 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -62.62 -25.8 68.29 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.578 0.704 . . . . 0.0 110.655 175.601 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.1 -3.09 50.83 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.984 178.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -106.31 172.39 6.84 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.8 tp -102.1 -45.8 5.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 176.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -122.69 -171.01 2.19 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.167 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.9 148.1 34.73 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.496 0.665 . . . . 0.0 111.623 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -114.45 178.51 4.26 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 176.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 3.1 p -132.17 131.97 42.75 Favored 'General case' 0 N--CA 1.414 -2.242 0 CA-C-N 118.908 0.776 . . . . 0.0 110.64 -175.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.6 p -110.2 130.77 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.191 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 176.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -102.03 141.94 34.1 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -174.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -155.76 177.38 11.46 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -116.86 155.49 28.93 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.13 -135.64 12.96 Favored Glycine 0 C--N 1.31 -0.912 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 -178.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.441 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 2.8 tm? -122.9 -42.84 2.27 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.489 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.586 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -136.29 159.01 43.05 Favored 'General case' 0 CA--C 1.478 -1.804 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.662 -177.274 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -121.21 126.71 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.638 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.5 m -57.64 140.53 50.91 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.178 176.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -57.87 -40.26 79.78 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 123.17 0.588 . . . . 0.0 112.491 -176.319 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.676 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 19.7 t -55.18 -46.92 75.84 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -66.03 -47.7 73.56 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.74 179.611 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.91 -46.61 89.97 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 123.561 0.538 . . . . 0.0 112.14 -177.066 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -66.08 -45.13 82.34 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.302 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.676 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -62.0 -35.56 78.89 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.271 0.357 . . . . 0.0 111.1 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 29.3 mm-40 -63.7 -50.6 68.55 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.425 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.6 mt -66.25 -45.57 89.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.566 -176.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.8 mtm -64.66 -40.5 95.54 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.278 -177.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.04 -41.59 47.43 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.235 179.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.63 -47.37 63.65 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.457 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 17.6 mm-40 -89.55 -2.74 58.43 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.405 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 18.8 mmmt 71.21 65.92 0.16 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 125.153 1.381 . . . . 0.0 111.288 178.825 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.457 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.9 mp -103.38 156.99 17.34 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.124 -0.944 . . . . 0.0 108.582 175.516 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -94.31 100.62 12.63 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 122.005 0.907 . . . . 0.0 109.782 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.08 -17.04 61.0 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.108 -174.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -98.2 1.73 47.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 179.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -124.3 -28.17 3.7 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.232 -0.987 . . . . 0.0 111.581 -177.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.4 p -135.68 159.65 40.98 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -108.47 157.34 18.53 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -179.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.41 HD12 ' CG1' ' A' ' 77' ' ' VAL . 23.6 tp -113.1 116.62 30.16 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.067 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.427 ' HB2' HG12 ' A' ' 80' ' ' ILE . 25.1 tt0 -116.21 115.08 25.35 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 121.806 0.812 . . . . 0.0 109.645 -176.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.4 mm -97.25 135.55 31.11 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 -174.293 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 m -121.19 141.36 50.93 Favored 'General case' 0 C--N 1.283 -2.294 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.467 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.485 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 12.4 t-20 -75.1 139.75 42.98 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.677 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.0 -28.54 39.42 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.336 0.589 . . . . 0.0 111.173 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -92.09 -49.18 6.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.425 -174.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.1 p -93.64 -19.79 20.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.982 0.42 . . . . 0.0 110.129 -174.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.2 mmmt 65.75 24.01 11.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.559 1.144 . . . . 0.0 111.139 -178.099 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -82.29 131.3 35.23 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -90.36 135.27 33.79 Favored 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 177.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -101.25 97.12 7.67 Favored 'General case' 0 C--N 1.263 -3.19 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.223 179.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -100.15 -25.39 14.3 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.985 -177.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -94.07 128.99 40.77 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -176.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.51 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -61.6 -10.74 8.9 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -91.68 -2.08 57.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.637 -178.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.29 151.14 47.35 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.586 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.16 138.94 52.59 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 118.385 0.539 . . . . 0.0 111.007 -177.642 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.48 113.98 36.45 Favored Pre-proline 0 C--N 1.315 -0.93 0 C-N-CA 119.689 -0.805 . . . . 0.0 110.445 173.027 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.7 Cg_endo -79.43 158.68 25.79 Favored 'Trans proline' 0 CA--C 1.519 -0.256 0 C-N-CA 123.128 2.552 . . . . 0.0 113.245 177.032 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -70.48 5.15 1.92 Allowed 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 121.57 0.7 . . . . 0.0 111.9 176.339 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.407 ' H ' ' C ' ' A' ' 70' ' ' PRO . 1.0 OUTLIER -87.95 -20.52 25.78 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.023 172.891 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -103.42 141.7 35.52 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -174.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -104.0 128.43 51.56 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 169.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 14.6 m -123.17 157.28 28.87 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.7 mm -103.71 125.96 58.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.41 ' CG1' HD12 ' A' ' 51' ' ' LEU . 46.4 t -100.78 114.27 39.26 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-O 121.397 0.617 . . . . 0.0 110.429 -177.515 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -113.11 138.85 49.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.887 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -100.41 128.52 46.45 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.427 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -127.85 153.61 78.09 Favored Pre-proline 0 C--N 1.312 -1.036 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.28 134.31 24.57 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 121.977 1.784 . . . . 0.0 111.993 179.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 pt -65.81 -30.78 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-O 121.077 0.465 . . . . 0.0 111.644 178.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 106.23 -62.06 0.33 Allowed Glycine 0 N--CA 1.425 -2.064 0 C-N-CA 121.018 -0.61 . . . . 0.0 111.86 179.712 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -96.31 80.3 0.75 Allowed Glycine 0 N--CA 1.428 -1.899 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.011 -178.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.7 m -76.78 86.42 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-O 122.428 1.109 . . . . 0.0 110.621 177.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.1 pttm . . . . . 0 C--N 1.302 -1.495 0 CA-C-N 113.561 -1.654 . . . . 0.0 112.051 -178.507 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.366 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -79.02 3.37 7.47 Favored 'Trans proline' 0 C--O 1.245 0.83 0 C-N-CA 123.308 2.672 . . . . 0.0 112.885 -179.022 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 91.3 mt 69.76 -82.73 0.03 OUTLIER 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.259 1.424 . . . . 0.0 111.171 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -146.77 141.13 9.18 Favored Glycine 0 N--CA 1.424 -2.13 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.275 -179.637 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.2 m -75.54 -21.83 57.59 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-O 121.771 0.796 . . . . 0.0 110.263 178.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 86.5 mtp -77.25 105.7 8.52 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 172.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 23' ' ' THR . 36.1 m -102.12 140.07 36.9 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.118 -172.18 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.7 p -139.59 134.84 32.68 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.629 -179.034 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 21' ' ' THR . 59.6 t -107.35 135.67 45.12 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.458 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -83.92 113.32 20.89 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.195 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.636 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 29.5 p90 -129.51 136.56 50.0 Favored 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.218 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -121.79 141.01 51.64 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 173.273 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.523 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -91.66 175.87 6.74 Favored 'General case' 0 C--N 1.277 -2.566 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 177.059 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -63.43 -30.65 71.74 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 171.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.4 m -79.53 -7.04 58.2 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.682 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.523 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 3.8 mptp? -105.06 134.25 48.48 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.302 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.27 -19.47 22.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.629 0.728 . . . . 0.0 109.226 178.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 8.2 p30 -129.96 173.92 10.25 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.553 179.012 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.89 129.05 36.96 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.268 0.556 . . . . 0.0 112.179 -177.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -89.58 177.59 6.51 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.55 -1.205 . . . . 0.0 108.47 175.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -135.76 131.49 35.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.169 0.509 . . . . 0.0 110.87 -177.238 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.5 p -113.75 127.54 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.086 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 7' ' ' SER . 8.5 p -99.83 143.69 29.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.374 0.606 . . . . 0.0 112.142 -176.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -153.23 171.03 19.14 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.157 178.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.14 135.33 51.82 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.12 -115.02 2.08 Favored Glycine 0 C--N 1.302 -1.341 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tt -149.14 -41.11 0.15 Allowed 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.585 ' CG ' HD11 ' A' ' 68' ' ' LEU . 1.1 p-80 -134.81 157.25 47.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 179.521 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 tt -122.78 125.67 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.993 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.553 -179.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.1 m -58.23 141.25 51.29 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.908 173.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.9 tp -54.63 -41.23 69.78 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.918 1.287 . . . . 0.0 111.409 -177.435 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.651 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 53.7 t -54.33 -45.24 72.63 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.452 178.198 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -72.63 -43.07 63.72 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 -176.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.493 ' CD2' HD11 ' A' ' 69' ' ' ILE . 0.6 OUTLIER -67.02 -40.85 87.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.24 -174.477 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 53.1 mtmt -62.36 -38.82 91.0 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.782 -179.431 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.651 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 3.9 mptp? -61.75 -40.42 95.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.638 177.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -63.18 -51.1 67.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.783 179.435 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.6 mt -68.81 -42.83 82.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.418 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.0 -35.25 80.07 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.384 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.5 -39.16 50.87 Favored Glycine 0 C--N 1.309 -0.924 0 C-N-CA 120.308 -0.948 . . . . 0.0 111.541 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -66.77 -43.41 84.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.893 0.877 . . . . 0.0 112.549 -177.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 76.5 mm-40 -99.95 3.61 44.46 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.882 0.373 . . . . 0.0 110.993 -178.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.4 mptt 57.86 66.51 1.11 Allowed 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.387 178.11 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -98.85 154.23 18.18 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.179 177.564 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -97.69 111.62 23.83 Favored 'General case' 0 N--CA 1.401 -2.893 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.98 -1.69 26.89 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.794 -178.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.33 -12.06 18.94 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.377 -177.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.89 -37.06 6.8 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.392 0.615 . . . . 0.0 110.323 -177.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.7 m -141.43 174.36 10.62 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.441 -178.442 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.511 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 6.3 t0 -119.44 169.87 9.65 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.412 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.9 tp -114.52 122.26 46.02 Favored 'General case' 0 C--N 1.273 -2.76 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -113.55 123.34 49.76 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -177.113 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -102.94 132.11 49.8 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.84 0 C-N-CA 119.867 -0.733 . . . . 0.0 109.115 179.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.4 m -117.27 146.92 42.99 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 179.376 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.498 ' HA ' HG11 ' A' ' 75' ' ' VAL . 11.7 t-20 -74.59 138.6 43.11 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -25.77 53.43 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-O 121.211 0.529 . . . . 0.0 110.379 -178.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -92.78 -56.52 2.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.553 -176.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.5 p -90.83 -16.27 28.57 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.248 -171.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 64.03 18.44 11.22 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -174.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.18 125.89 28.08 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 175.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -89.51 125.67 35.28 Favored 'General case' 0 C--N 1.288 -2.094 0 CA-C-O 121.298 0.57 . . . . 0.0 110.676 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -92.61 100.15 12.73 Favored 'General case' 0 C--N 1.278 -2.507 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.4 p -98.2 -26.09 14.67 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.743 -175.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -95.35 135.54 36.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.19 -17.85 63.93 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.493 0.717 . . . . 0.0 110.784 -178.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -81.64 -8.75 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.727 -178.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.83 144.36 56.66 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.624 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.585 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.73 137.68 52.53 Favored 'General case' 0 C--N 1.294 -1.835 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -176.805 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.493 HD11 ' CD2' ' A' ' 34' ' ' LEU . 3.8 mp -119.69 116.48 33.16 Favored Pre-proline 0 C--N 1.302 -1.477 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.236 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 75.8 Cg_endo -80.75 160.8 21.64 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.373 2.716 . . . . 0.0 113.879 177.735 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -63.79 -8.74 11.58 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.93 175.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -81.48 -17.38 48.88 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.646 178.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 37.8 m -105.81 152.74 22.85 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.784 0.802 . . . . 0.0 111.856 -175.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 m -114.45 129.75 56.68 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 170.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.6 m -128.57 164.28 30.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 120.909 0.385 . . . . 0.0 110.917 -176.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.0 mt -122.8 129.04 75.43 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 20.3 t -100.39 132.62 45.67 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.468 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.089 -173.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -130.26 143.16 50.61 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 -176.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -97.36 134.07 41.12 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 pp -124.77 148.9 60.88 Favored Pre-proline 0 C--N 1.303 -1.429 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.934 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.61 132.27 18.59 Favored 'Trans proline' 0 N--CA 1.447 -1.254 0 C-N-CA 122.188 1.925 . . . . 0.0 111.713 178.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.511 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 31.5 pt -84.01 -22.43 8.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.392 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 137.2 -27.78 2.85 Favored Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.447 ' H ' HG13 ' A' ' 82' ' ' ILE . . . 137.21 178.32 15.79 Favored Glycine 0 N--CA 1.412 -2.96 0 N-CA-C 108.666 -1.774 . . . . 0.0 108.666 -179.873 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 65.5 t -78.3 97.85 2.3 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.907 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.478 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.6 pttt . . . . . 0 C--N 1.302 -1.486 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.164 -177.634 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.331 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -62.02 -53.56 2.0 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 123.151 2.567 . . . . 0.0 113.21 -177.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 pp -73.36 -25.42 60.58 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.57 85.17 0.27 Allowed Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 178.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.7 m -85.3 76.05 10.18 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.71 0.767 . . . . 0.0 110.05 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 85.9 mtp -80.75 162.49 24.07 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.587 179.548 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.556 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.4 m -115.04 116.46 28.48 Favored 'General case' 0 N--CA 1.405 -2.684 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.532 ' SG ' HG23 ' A' ' 23' ' ' THR . 83.8 m -138.38 133.51 33.0 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.917 -174.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.541 HG21 ' CE1' ' A' ' 24' ' ' PHE . 79.1 t -106.14 130.52 57.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.473 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 42.7 m-70 -88.63 120.17 29.78 Favored 'General case' 0 CA--C 1.482 -1.652 0 O-C-N 124.227 0.954 . . . . 0.0 109.106 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.622 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.1 p90 -132.95 139.93 47.56 Favored 'General case' 0 C--N 1.278 -2.515 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.22 148.49 43.62 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.433 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -85.97 165.45 16.72 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.957 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -66.08 -30.9 71.5 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.41 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.2 t -74.34 -57.11 4.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.87 176.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 13' ' ' PHE . 54.5 mtmt -67.4 143.22 56.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.094 0.557 . . . . 0.0 111.7 -178.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.15 -37.65 14.05 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.162 -175.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -100.76 163.23 12.42 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.528 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -87.94 152.17 22.26 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.374 0.607 . . . . 0.0 111.553 -177.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.473 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.8 t70 -121.71 176.69 5.59 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 176.449 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 4.6 p -133.33 131.17 39.81 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.504 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -95.5 117.33 39.26 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.165 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 170.157 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.532 HG23 ' SG ' ' A' ' 8' ' ' CYS . 39.9 p -86.01 121.41 28.59 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.406 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.556 ' O ' ' HB2' ' A' ' 7' ' ' SER . 16.0 p90 -143.24 161.6 37.85 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -178.106 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -101.13 132.51 46.57 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.0 -163.39 23.49 Favored Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -177.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 58.0 tp -106.97 -35.52 6.88 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 176.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.502 ' CG ' HD11 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -144.3 156.94 44.48 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.261 -179.242 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -126.14 131.15 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.91 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.432 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.8 m -64.98 145.54 56.2 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.131 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 47.6 tp -54.87 -46.27 74.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -172.672 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.49 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 12.7 t -58.57 -42.73 88.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 118.994 0.815 . . . . 0.0 109.87 179.412 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 6.1 m-20 -65.06 -43.51 92.0 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.132 179.193 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.29 -46.34 90.17 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.893 -179.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 52.4 mtmt -66.78 -40.57 88.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 -179.92 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.2 mptt -61.87 -34.41 75.96 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.668 178.116 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 13.3 mm100 -65.4 -50.1 66.75 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 110.102 176.115 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.3 mt -68.61 -47.13 78.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.604 -176.689 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.0 mtm -63.09 -44.3 96.11 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.17 -178.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -39.03 91.56 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.834 179.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.03 -51.51 63.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.085 0.469 . . . . 0.0 110.745 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -97.43 11.26 37.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -171.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt 67.67 38.89 2.88 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.426 1.09 . . . . 0.0 112.036 171.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.07 167.34 22.05 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.429 ' H ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -105.47 102.43 11.9 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.681 178.762 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.62 -13.7 60.04 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.52 -176.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.58 -6.85 59.12 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.871 -179.1 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.505 ' O ' HG12 ' A' ' 82' ' ' ILE . 32.0 t70 -126.62 -33.08 2.57 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.511 0.672 . . . . 0.0 111.107 178.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.3 m -129.27 161.71 29.58 Favored 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.337 -175.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.434 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 10.5 t70 -118.81 171.26 8.34 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 178.171 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 35' ' ' LYS . 18.2 tp -118.48 117.69 29.71 Favored 'General case' 0 N--CA 1.395 -3.193 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -174.067 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.489 ' HA ' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -101.4 123.53 45.62 Favored 'General case' 0 C--N 1.284 -2.249 0 O-C-N 120.932 -1.105 . . . . 0.0 108.408 -177.714 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.8 mm -110.23 130.67 63.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.7 m -117.13 139.48 50.68 Favored 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.371 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.509 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.8 t-20 -65.79 136.5 56.28 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 176.031 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.33 -26.18 55.51 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.254 0.549 . . . . 0.0 111.427 -177.41 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -95.69 -52.2 4.2 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.28 -176.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -90.16 -18.61 25.47 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.25 0.548 . . . . 0.0 110.223 -174.112 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 66.05 21.83 11.21 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.731 1.212 . . . . 0.0 112.153 -177.239 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -70.72 121.63 18.32 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.597 174.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -90.18 117.98 29.35 Favored 'General case' 0 N--CA 1.405 -2.723 0 CA-C-O 122.0 0.905 . . . . 0.0 110.838 -178.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -87.63 92.84 9.25 Favored 'General case' 0 C--N 1.272 -2.767 0 CA-C-N 114.101 -1.408 . . . . 0.0 107.75 -179.583 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.8 p -93.23 -17.77 23.28 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.375 -176.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -101.55 128.82 47.63 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.388 -178.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 7.8 p-10 -67.72 -7.08 24.23 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -90.79 -2.87 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.447 176.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.2 150.56 47.34 Favored 'General case' 0 C--O 1.206 -1.205 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.203 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.502 HD11 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.04 138.33 52.29 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 118.085 0.402 . . . . 0.0 110.84 -177.071 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.28 116.04 37.63 Favored Pre-proline 0 C--N 1.314 -0.956 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.563 176.11 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.0 Cg_endo -79.39 158.77 25.96 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 123.162 2.574 . . . . 0.0 113.418 176.036 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -66.67 -10.26 44.49 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.659 178.194 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -87.77 -3.88 58.92 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.386 178.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -112.59 150.88 30.76 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 121.261 0.553 . . . . 0.0 111.476 -178.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -109.73 126.7 54.0 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 13.9 m -124.57 164.77 22.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.424 0.63 . . . . 0.0 112.553 -176.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -124.3 136.07 61.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 C-N-CA 124.295 1.038 . . . . 0.0 108.728 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.17 129.28 56.69 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.612 -172.323 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -129.01 140.65 51.55 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -98.64 131.94 44.43 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.607 178.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -128.93 152.84 79.82 Favored Pre-proline 0 C--O 1.206 -1.199 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.029 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -74.0 134.69 20.01 Favored 'Trans proline' 0 C--N 1.318 -1.069 0 C-N-CA 122.308 2.006 . . . . 0.0 111.579 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 48' ' ' ASP . 10.6 pt -66.65 -41.11 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.022 178.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.33 -45.23 25.26 Favored Glycine 0 N--CA 1.44 -1.097 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.06 -87.56 0.48 Allowed Glycine 0 C--N 1.304 -1.231 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.701 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.5 t -75.13 110.05 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 -179.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 C--N 1.293 -1.854 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 178.226 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.229 0 CA-C-O 119.177 -0.791 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -63.61 -40.97 27.22 Favored 'Trans proline' 0 C--N 1.361 1.197 0 C-N-CA 122.853 2.369 . . . . 0.0 112.723 -178.664 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.9 tp -158.64 99.73 1.59 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.071 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.77 9.75 5.21 Favored Glycine 0 C--N 1.301 -1.363 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.485 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.6 m 62.53 85.31 0.13 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 110.902 -177.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.2 mtp -65.76 115.93 6.42 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.688 177.372 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.465 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 64.1 m -89.82 135.52 33.58 Favored 'General case' 0 N--CA 1.412 -2.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.497 -178.663 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 27.3 p -144.25 144.48 31.53 Favored 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.49 HG22 ' CE1' ' A' ' 24' ' ' PHE . 91.2 t -105.57 132.43 52.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.331 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -82.84 104.7 13.26 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.421 ' HB2' ' CG2' ' A' ' 77' ' ' VAL . 38.2 p90 -120.71 141.23 50.62 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 -177.426 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -124.51 126.09 45.29 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 118.102 -1.439 . . . . 0.0 110.164 175.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.26 157.2 19.99 Favored 'General case' 0 C--N 1.286 -2.166 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 178.176 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.7 m -60.0 -25.06 64.97 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 120.809 0.338 . . . . 0.0 111.53 177.479 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 t -95.1 -4.75 45.69 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 121.549 0.69 . . . . 0.0 110.615 178.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.24 -43.3 11.08 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 121.712 -0.618 . . . . 0.0 110.642 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 71.89 -47.31 0.66 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.478 1.511 . . . . 0.0 111.722 -176.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -100.92 169.44 8.97 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 175.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -83.36 144.96 29.31 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.536 0.684 . . . . 0.0 112.059 -176.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -113.91 177.97 4.45 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 176.012 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.68 123.0 17.05 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.519 0.599 . . . . 0.0 110.875 -174.005 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -102.36 119.68 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 176.696 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 p -87.58 134.52 33.61 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.138 -178.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.49 ' CE1' HG22 ' A' ' 9' ' ' VAL . 34.7 p90 -144.79 176.0 9.77 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.715 -177.287 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -103.9 131.19 51.37 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.73 179.83 20.88 Favored Glycine 0 C--O 1.209 -1.407 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -83.49 -31.62 26.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.517 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -136.93 157.35 46.95 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.58 -177.862 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.06 132.48 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.783 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.573 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.457 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 6.3 m -60.83 145.49 49.72 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.408 0.683 . . . . 0.0 109.976 177.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.422 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.9 tp -57.7 -43.1 84.94 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 124.134 0.974 . . . . 0.0 112.729 -176.306 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.594 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.5 t -59.13 -45.6 90.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.635 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 14.1 m-20 -62.71 -48.77 77.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.824 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.13 -46.54 89.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.405 -176.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 39' ' ' MET . 45.6 mtmt -65.46 -44.41 87.29 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.602 -179.151 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.594 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.3 mptt -61.92 -33.45 74.28 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 116.72 -0.218 . . . . 0.0 111.263 178.251 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.635 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 24.5 mm-40 -63.76 -49.83 71.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.9 mt -67.4 -49.43 71.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.439 -177.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 93.6 mtp -61.68 -44.91 96.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.497 -175.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.72 61.54 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.305 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -72.74 -51.03 20.87 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.32 0.581 . . . . 0.0 111.628 -177.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -87.04 -9.47 55.41 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -170.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 46.8 mmtt 76.66 67.06 0.05 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 124.683 1.193 . . . . 0.0 111.654 -179.787 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -104.12 129.48 51.83 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 173.684 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.447 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 23.9 ttmm -77.67 112.7 14.76 Favored 'General case' 0 N--CA 1.408 -2.573 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.256 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -0.9 30.27 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.079 -178.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 3.24 35.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.487 0.66 . . . . 0.0 109.297 178.849 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.447 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 23.0 t70 -118.59 -51.13 2.4 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.407 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.3 m -134.05 168.04 19.54 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.064 179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -113.6 169.47 8.95 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 -179.773 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.528 HD12 ' CG1' ' A' ' 77' ' ' VAL . 26.2 tp -116.78 125.32 51.44 Favored 'General case' 0 C--N 1.271 -2.832 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.49 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -115.99 136.5 52.98 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -179.576 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 77' ' ' VAL . 39.0 mm -121.87 135.59 61.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -176.428 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.2 m -128.77 144.51 51.19 Favored 'General case' 0 C--O 1.196 -1.741 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 176.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.469 ' HA ' HG13 ' A' ' 75' ' ' VAL . 11.6 t-20 -72.95 138.43 46.11 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.737 -0.602 . . . . 0.0 109.869 179.679 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.86 -26.19 49.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.237 0.541 . . . . 0.0 111.015 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -94.69 -52.41 4.3 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.475 -176.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 p -90.88 -16.27 28.47 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.202 0.525 . . . . 0.0 110.47 -172.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 66.01 21.79 11.26 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.962 -179.522 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -83.61 130.92 34.99 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.417 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.25 143.94 33.29 Favored 'General case' 0 N--CA 1.416 -2.14 0 CA-C-O 121.024 0.44 . . . . 0.0 110.151 174.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -103.92 99.06 8.82 Favored 'General case' 0 C--N 1.273 -2.74 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.2 p -91.32 -27.24 18.52 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.804 -173.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -101.34 143.58 31.21 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.496 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.3 p-10 -74.35 -11.07 60.15 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.733 0.301 . . . . 0.0 111.785 -177.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -3.46 58.83 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.703 178.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.86 58.66 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 174.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.517 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.52 137.74 52.36 Favored 'General case' 0 C--N 1.289 -2.051 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.338 -174.685 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.27 117.37 34.91 Favored Pre-proline 0 C--N 1.306 -1.303 0 C-N-CA 119.616 -0.833 . . . . 0.0 110.551 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.427 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 55.7 Cg_endo -76.86 152.76 32.62 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.374 2.716 . . . . 0.0 113.244 175.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.465 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 42.4 pttt -57.69 -22.2 44.84 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -86.95 -1.75 58.08 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 120.961 0.41 . . . . 0.0 111.756 -177.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -106.9 147.23 30.05 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 -178.424 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.4 p -109.13 124.39 50.73 Favored 'General case' 0 N--CA 1.424 -1.727 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.469 HG13 ' HA ' ' A' ' 55' ' ' ASN . 15.9 m -123.39 149.98 27.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.569 0.7 . . . . 0.0 112.65 -177.44 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.6 mm -94.18 126.07 46.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 178.876 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.528 ' CG1' HD12 ' A' ' 51' ' ' LEU . 59.7 t -106.51 122.03 59.88 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -177.152 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -126.04 134.41 51.44 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.24 -173.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -90.27 116.78 28.5 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.419 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.49 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.77 150.52 48.54 Favored Pre-proline 0 C--N 1.308 -1.226 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.276 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.33 138.43 42.77 Favored 'Trans proline' 0 C--N 1.325 -0.668 0 C-N-CA 122.182 1.922 . . . . 0.0 111.876 -179.086 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.2 pt -73.82 -28.87 24.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.5 -86.64 0.66 Allowed Glycine 0 N--CA 1.41 -3.033 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -175.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -147.28 1.54 0.76 Allowed Glycine 0 N--CA 1.425 -2.048 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.748 179.478 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 8.1 m -77.84 86.46 0.98 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 122.388 1.089 . . . . 0.0 112.673 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm . . . . . 0 C--N 1.293 -1.88 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 178.505 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.495 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -83.28 99.16 0.85 Allowed 'Trans proline' 0 N--CA 1.437 -1.801 0 C-N-CA 122.089 1.859 . . . . 0.0 111.228 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 pp -96.44 7.75 45.74 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-O 122.051 0.929 . . . . 0.0 110.567 -179.179 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.23 -95.82 0.12 Allowed Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.795 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.7 m -125.84 98.76 5.67 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.028 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.6 mtp -63.98 137.26 57.92 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.785 -175.652 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 m -76.07 135.03 39.9 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.534 -179.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.9 p -149.6 145.29 26.7 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 119.681 -0.808 . . . . 0.0 110.896 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 21' ' ' THR . 91.0 t -107.02 128.74 61.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.341 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.455 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 21.6 m-70 -77.68 105.54 8.91 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 173.89 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.546 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 33.7 p90 -123.41 140.82 52.62 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -178.305 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -117.02 137.77 52.02 Favored 'General case' 0 C--N 1.286 -2.182 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 172.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.422 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 2.2 t80 -89.9 166.69 13.35 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -178.66 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.4 t -58.94 -31.5 68.74 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.627 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 m -84.6 -7.07 59.38 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.31 -179.982 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 95.6 mttt -116.87 124.38 49.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.422 0.629 . . . . 0.0 110.67 -177.12 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -81.93 -20.57 38.4 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.651 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -114.01 164.69 13.47 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.372 -0.831 . . . . 0.0 108.8 179.852 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -83.94 148.22 27.04 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 121.87 0.843 . . . . 0.0 111.601 -179.586 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.455 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.8 t0 -120.0 178.04 4.76 Favored 'General case' 0 C--N 1.279 -2.463 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -134.85 128.52 32.85 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 118.209 0.459 . . . . 0.0 110.07 -175.536 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.3 p -106.9 122.26 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.144 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.2 p -89.41 135.31 33.66 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -177.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.446 ' CE1' HG22 ' A' ' 9' ' ' VAL . 34.1 p90 -146.73 165.61 29.12 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -176.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -95.55 111.05 23.04 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 123.953 0.783 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.74 -174.17 20.26 Favored Glycine 0 C--N 1.298 -1.539 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 tt -95.27 -26.87 15.77 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 177.434 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.422 ' CG ' HD12 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -143.31 151.76 40.88 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.465 178.699 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.5 tt -125.91 135.06 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.925 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.622 -177.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -62.17 141.75 58.01 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.383 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 52.1 tp -57.1 -43.22 82.03 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 123.502 0.721 . . . . 0.0 112.404 -175.616 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.522 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.4 t -56.45 -45.32 80.87 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.061 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -65.32 -42.06 93.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.376 179.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.61 -46.53 87.85 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 -179.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 44.7 mtmt -66.02 -40.43 91.07 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.248 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.522 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.89 -39.47 92.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.303 176.439 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -65.34 -50.72 64.54 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.629 177.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 75.7 mt -62.76 -48.29 88.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 123.562 0.539 . . . . 0.0 111.986 -177.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.6 mtm -64.72 -37.3 87.12 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.635 -178.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.91 64.14 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.188 -1.006 . . . . 0.0 111.36 177.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -63.51 -45.1 92.2 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.173 0.989 . . . . 0.0 111.658 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.467 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 31.7 mt-10 -103.39 3.33 35.01 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.907 -176.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.27 66.13 0.91 Allowed 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 124.614 1.166 . . . . 0.0 111.664 178.052 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.467 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.5 mp -98.69 135.09 40.69 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.597 177.553 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -77.79 108.33 10.94 Favored 'General case' 0 N--CA 1.414 -2.247 0 CA-C-O 121.45 0.643 . . . . 0.0 109.951 179.143 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.55 1.67 25.02 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.16 179.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.17 -0.88 35.23 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.65 0.738 . . . . 0.0 109.852 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -115.68 -36.33 4.25 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.001 -1.0 . . . . 0.0 108.412 179.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.58 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 17.1 p -143.32 168.68 19.23 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.962 -174.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -116.12 169.38 9.31 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 177.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.4 tp -120.32 123.01 42.08 Favored 'General case' 0 C--N 1.259 -3.342 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 -178.401 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.473 ' HB2' HG12 ' A' ' 80' ' ' ILE . 41.9 tt0 -115.54 119.21 35.4 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -175.326 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.7 mp -105.87 132.56 52.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 CA-C-O 121.407 0.622 . . . . 0.0 111.032 -176.138 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.4 m -113.94 148.63 36.5 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.344 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.543 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -75.35 141.81 43.27 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 175.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.34 -28.33 42.04 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 0.0 110.989 -178.824 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -93.89 -53.33 4.04 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.384 -175.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -84.95 -22.47 29.19 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -174.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 65.57 23.07 11.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.408 -175.833 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.47 132.18 36.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.226 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -91.15 117.11 29.35 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-O 121.505 0.669 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -86.77 93.72 9.34 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -92.42 -10.01 39.56 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.492 -177.413 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.778 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 10.5 m-20 -101.73 132.09 47.64 Favored 'General case' 0 CA--C 1.479 -1.769 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.837 176.111 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.46 0.22 30.39 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.269 0.557 . . . . 0.0 111.666 -178.786 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.778 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 9.7 p30 -90.66 1.8 56.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.797 178.337 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.31 154.47 40.94 Favored 'General case' 0 C--O 1.208 -1.091 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.422 HD12 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.45 137.39 53.2 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.68 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.42 116.68 33.44 Favored Pre-proline 0 C--N 1.302 -1.46 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.396 177.009 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -80.15 155.94 22.75 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.294 2.662 . . . . 0.0 113.75 176.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 13.6 ptmt -58.3 -21.43 49.01 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.825 178.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -87.11 -1.25 57.75 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 120.818 0.342 . . . . 0.0 111.6 -177.617 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.6 m -112.81 149.03 33.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.424 -178.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.4 p -109.39 132.49 54.08 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.9 m -132.03 160.76 42.24 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 121.405 0.621 . . . . 0.0 112.556 -177.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -108.53 125.57 65.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 179.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 43.3 t -104.86 109.72 28.51 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-O 121.517 0.675 . . . . 0.0 109.759 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -113.58 129.16 56.61 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.255 -175.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.58 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 56.5 ttp180 -91.6 129.87 37.5 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -179.213 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.473 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -130.38 153.3 81.28 Favored Pre-proline 0 C--N 1.309 -1.189 0 C-N-CA 121.116 -0.234 . . . . 0.0 110.413 -175.653 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.22 136.77 41.6 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 121.931 1.754 . . . . 0.0 111.122 178.103 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.7 pt -60.78 -31.74 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.915 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -91.52 14.25 64.42 Favored Glycine 0 N--CA 1.439 -1.124 0 C-N-CA 121.078 -0.582 . . . . 0.0 111.993 178.009 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -144.35 65.74 0.45 Allowed Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 178.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.0 t -81.26 87.18 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.675 0.75 . . . . 0.0 109.983 -177.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt . . . . . 0 N--CA 1.425 -1.704 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.354 -179.264 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 55.3 m . . . . . 0 N--CA 1.413 -2.32 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.551 ' SG ' HG22 ' A' ' 23' ' ' THR . 58.0 m -125.86 128.93 48.38 Favored 'General case' 0 C--N 1.291 -1.945 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.195 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' CE1' ' A' ' 24' ' ' PHE . 25.3 t -108.11 124.66 64.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.853 175.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -81.29 105.98 12.91 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.03 -0.987 . . . . 0.0 108.377 173.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.583 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.0 p90 -118.6 126.01 51.03 Favored 'General case' 0 C--N 1.278 -2.535 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.14 133.07 50.53 Favored 'General case' 0 C--N 1.278 -2.515 0 C-N-CA 118.536 -1.265 . . . . 0.0 107.688 176.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.402 ' HA ' ' HB ' ' A' ' 77' ' ' VAL . 1.0 OUTLIER -82.93 150.52 26.39 Favored 'General case' 0 C--N 1.282 -2.333 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 p -64.43 -24.79 67.75 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.43 0.633 . . . . 0.0 110.648 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 m -80.47 -15.59 56.39 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.861 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.443 ' HB3' ' OD1' ' A' ' 18' ' ' ASN . 82.3 mttt -104.44 157.78 16.93 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.82 0.819 . . . . 0.0 112.492 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -96.74 1.24 50.68 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.054 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.443 ' OD1' ' HB3' ' A' ' 16' ' ' LYS . 30.3 p-10 -145.6 164.91 30.25 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.787 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -91.82 139.4 30.71 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.04 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.17 177.62 4.75 Favored 'General case' 0 C--N 1.279 -2.46 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -144.26 120.83 11.08 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -172.198 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.431 HG13 ' CE1' ' A' ' 11' ' ' TYR . 1.9 m -95.23 126.83 47.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.551 HG22 ' SG ' ' A' ' 8' ' ' CYS . 10.8 p -98.93 118.19 35.15 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.471 ' CE1' HG23 ' A' ' 9' ' ' VAL . 43.4 p90 -131.46 175.59 9.02 Favored 'General case' 0 C--N 1.281 -2.394 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.624 -178.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -107.81 150.34 27.12 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.876 0.735 . . . . 0.0 109.799 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.41 -114.74 4.2 Favored Glycine 0 N--CA 1.42 -2.398 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tt -152.58 -41.08 0.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.541 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -133.49 152.63 51.93 Favored 'General case' 0 CA--C 1.49 -1.364 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.954 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -117.9 127.34 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.574 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.97 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.4 m -63.09 140.29 58.86 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 62' ' ' TYR . 59.5 tp -54.64 -39.23 67.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 124.64 1.176 . . . . 0.0 112.561 -175.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.679 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -54.38 -46.91 73.16 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -74.93 -36.86 62.15 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.821 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.9 -47.34 85.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.721 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.7 mtmt -71.69 -44.92 63.37 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.644 -178.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.679 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.2 mptt -61.38 -35.16 76.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.273 -0.422 . . . . 0.0 112.023 -178.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.39 -49.66 62.97 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 120.481 -0.488 . . . . 0.0 109.891 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -64.97 -42.33 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.971 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 57.4 mtt -59.78 -44.89 93.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.696 0.284 . . . . 0.0 111.237 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.07 -31.01 62.25 Favored Glycine 0 C--N 1.317 -0.491 0 CA-C-O 121.664 0.591 . . . . 0.0 112.058 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.7 ttt85 -69.32 -51.28 38.65 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 123.766 0.826 . . . . 0.0 111.646 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 40.0 mm-40 -92.98 -14.23 27.73 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -172.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp 77.75 72.3 0.06 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 125.657 1.583 . . . . 0.0 111.236 -177.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.9 mp -101.0 153.85 19.19 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.089 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.638 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.96 101.88 14.23 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.666 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.02 -12.56 59.69 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.443 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.39 -15.71 57.42 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.23 177.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -117.26 -31.31 5.34 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.588 0.709 . . . . 0.0 110.606 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.0 m -129.2 165.25 21.71 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-O 122.295 1.045 . . . . 0.0 113.787 -172.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.459 ' HB3' HD11 ' A' ' 80' ' ' ILE . 49.5 t0 -123.08 169.66 10.97 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 173.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 35' ' ' LYS . 14.2 tp -115.34 120.09 38.48 Favored 'General case' 0 C--N 1.257 -3.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.564 ' HB2' HG12 ' A' ' 80' ' ' ILE . 47.8 tp60 -106.49 123.45 48.1 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-O 121.267 0.556 . . . . 0.0 109.604 -176.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 77' ' ' VAL . 19.8 mm -114.29 135.43 54.07 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -172.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.5 m -125.89 140.78 52.36 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.601 ' HA ' HG12 ' A' ' 75' ' ' VAL . 9.5 t-20 -72.55 138.22 46.76 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.28 -16.56 34.81 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.436 0.636 . . . . 0.0 110.723 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -99.17 -44.51 6.24 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.842 -173.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -100.38 -19.08 16.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.191 0.519 . . . . 0.0 110.254 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.9 mmmm 71.96 12.45 6.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.051 1.341 . . . . 0.0 112.155 -177.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.1 135.35 46.22 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.059 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -92.86 145.26 24.53 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.296 0.57 . . . . 0.0 110.544 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.432 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 82.3 m-85 -105.18 98.01 7.77 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -90.56 -37.67 13.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -101.17 150.59 22.79 Favored 'General case' 0 CA--C 1.495 -1.17 0 C-N-CA 120.482 -0.487 . . . . 0.0 109.831 -177.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.606 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -64.32 -15.21 59.87 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.08 -11.17 58.25 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -62.19 141.19 58.32 Favored 'General case' 0 C--O 1.19 -2.038 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 -178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.541 HD13 ' CG ' ' A' ' 28' ' ' HIS . 2.8 pp -117.2 137.72 52.17 Favored 'General case' 0 C--N 1.289 -2.065 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.137 -171.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.34 112.53 43.76 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 48.8 Cg_endo -78.0 156.63 30.51 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 C-N-CA 122.803 2.335 . . . . 0.0 112.865 175.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 47.9 pttt -58.24 -17.5 19.7 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.429 0.692 . . . . 0.0 112.535 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -82.71 -1.95 52.8 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.918 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.436 ' HB3' HD21 ' A' ' 55' ' ' ASN . 35.1 m -115.46 118.61 33.67 Favored 'General case' 0 N--CA 1.424 -1.773 0 O-C-N 122.221 -0.3 . . . . 0.0 111.371 -177.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 m -89.8 123.21 33.58 Favored 'General case' 0 N--CA 1.425 -1.689 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.601 HG12 ' HA ' ' A' ' 55' ' ' ASN . 25.9 m -121.39 160.03 23.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 CA-C-O 120.945 0.402 . . . . 0.0 111.783 -172.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.7 mm -107.5 133.97 50.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 53' ' ' ILE . 57.3 t -106.44 117.75 52.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.444 -176.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -114.46 137.28 52.04 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -92.74 124.64 36.89 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.548 -0.72 . . . . 0.0 109.666 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.564 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -125.89 149.34 65.66 Favored Pre-proline 0 C--O 1.206 -1.202 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.144 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 C--N 1.32 -0.963 0 C-N-CA 122.297 1.998 . . . . 0.0 111.827 178.002 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 73.4 m . . . . . 0 N--CA 1.392 -3.372 0 CA-C-O 121.201 0.524 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.1 p -139.04 135.66 34.46 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.385 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.596 HG23 ' CE1' ' A' ' 24' ' ' PHE . 69.1 t -105.19 129.57 57.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -82.97 115.76 21.95 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.91 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.597 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 51.0 p90 -133.66 142.01 47.85 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -120.25 136.99 54.47 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 118.331 -1.348 . . . . 0.0 108.124 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -83.96 174.63 10.18 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -56.55 -37.31 70.35 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.157 0.583 . . . . 0.0 112.482 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.3 m -90.96 1.68 56.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.185 0.517 . . . . 0.0 111.498 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 1.4 mptm? -98.13 127.32 44.0 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.496 0.665 . . . . 0.0 111.615 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.8 tp -91.4 -21.65 20.87 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.964 -1.016 . . . . 0.0 108.341 175.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.22 149.11 46.76 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.011 -1.449 . . . . 0.0 108.954 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -78.16 147.2 34.64 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.422 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 28.4 m-20 -101.11 173.87 6.26 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.9 p -136.15 132.35 35.9 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -102.33 126.15 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 169.602 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.9 p -94.51 129.54 41.26 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.596 ' CE1' HG23 ' A' ' 9' ' ' VAL . 32.3 p90 -145.99 158.68 43.87 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -95.35 132.9 39.88 Favored 'General case' 0 C--N 1.296 -1.752 0 C-N-CA 119.994 -0.683 . . . . 0.0 111.072 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.92 -146.93 17.39 Favored Glycine 0 N--CA 1.437 -1.297 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.37 -41.95 2.58 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.5 OUTLIER -131.53 152.74 50.49 Favored 'General case' 0 CA--C 1.479 -1.764 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.264 177.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.529 ' HB ' ' CD2' ' A' ' 24' ' ' PHE . 12.4 tt -119.34 126.09 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.732 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.262 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.1 m -55.54 142.31 33.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.492 ' HG ' ' HE2' ' A' ' 35' ' ' LYS . 60.0 tp -58.36 -38.08 76.5 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.749 0.82 . . . . 0.0 112.309 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 35.6 t -56.18 -46.92 79.18 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 30.3 t70 -69.91 -37.89 76.11 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.291 -174.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.07 -46.53 67.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.781 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HE2' ' HG ' ' A' ' 31' ' ' LEU . 51.9 mtmt -66.03 -40.06 90.72 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.357 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -64.02 -35.2 79.93 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 123.552 0.532 . . . . 0.0 111.163 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 94.6 mt-30 -65.0 -47.21 78.33 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.65 -44.73 93.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.258 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 54.5 mtt -60.12 -43.83 95.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.673 0.273 . . . . 0.0 110.465 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -33.12 73.22 Favored Glycine 0 C--N 1.317 -0.525 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.54 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -70.97 -51.25 26.77 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.988 0.423 . . . . 0.0 111.186 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -84.57 -6.59 59.38 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.427 -172.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 7.6 mmmm 67.03 46.97 1.45 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 3.6 tp -83.3 115.61 22.06 Favored 'General case' 0 N--CA 1.411 -2.406 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.095 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.686 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.49 109.9 8.35 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-O 121.711 0.767 . . . . 0.0 110.289 177.432 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.31 58.16 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.787 -174.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.91 -1.71 57.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.556 0.694 . . . . 0.0 110.125 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.482 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 22.0 t70 -108.99 -51.65 2.86 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.794 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.7 m -140.01 164.62 29.53 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.446 0.641 . . . . 0.0 111.91 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -108.61 170.57 7.94 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' CG1' ' A' ' 77' ' ' VAL . 17.5 tp -118.58 112.5 19.95 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-O 121.334 0.588 . . . . 0.0 109.847 -172.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.449 ' HB2' HG12 ' A' ' 80' ' ' ILE . 19.0 tt0 -101.91 125.67 48.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.4 mm -113.21 132.7 61.32 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -126.39 141.24 51.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 122.338 -0.226 . . . . 0.0 110.43 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.519 ' HA ' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -59.52 124.24 19.43 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 122.856 0.462 . . . . 0.0 110.79 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.88 -28.91 64.89 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.79 -48.21 7.4 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.474 -0.785 . . . . 0.0 112.898 -175.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.9 p -103.83 -8.04 20.07 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.292 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 59.3 25.13 13.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.71 126.17 30.6 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -91.25 137.71 32.15 Favored 'General case' 0 C--N 1.287 -2.109 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -103.9 106.61 17.17 Favored 'General case' 0 C--N 1.278 -2.503 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.0 p -101.94 -17.9 15.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.021 -175.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' HD23 ' A' ' 31' ' ' LEU . 5.2 t70 -106.18 139.78 40.16 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.201 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.676 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -62.75 -16.48 57.93 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 122.886 0.474 . . . . 0.0 111.969 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.37 -10.36 59.4 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.472 0.309 . . . . 0.0 111.479 -178.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.21 150.22 47.71 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.514 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.523 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -118.86 138.29 52.84 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 118.655 0.661 . . . . 0.0 111.225 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -121.19 117.17 30.73 Favored Pre-proline 0 C--N 1.316 -0.86 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.507 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 58.7 Cg_endo -76.67 154.89 35.13 Favored 'Trans proline' 0 C--N 1.332 -0.293 0 C-N-CA 123.148 2.565 . . . . 0.0 113.66 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.45 -8.61 55.94 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 122.092 0.949 . . . . 0.0 111.263 178.42 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -85.18 -1.67 57.16 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.527 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.8 m -119.81 174.58 6.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-O 121.427 0.632 . . . . 0.0 110.947 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.3 m -138.03 139.95 39.86 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 4.5 m -132.56 161.61 41.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 35.3 mm -106.36 131.84 55.06 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.504 ' CG1' HD11 ' A' ' 51' ' ' LEU . 49.7 t -105.06 117.22 50.34 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.198 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -119.71 121.27 38.84 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 121.569 0.7 . . . . 0.0 110.849 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -81.68 118.64 22.99 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.211 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.449 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.59 154.03 66.42 Favored Pre-proline 0 C--O 1.211 -0.946 0 N-CA-C 110.359 -0.237 . . . . 0.0 110.359 -176.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo . . . . . 0 C--N 1.331 -0.388 0 C-N-CA 122.364 2.043 . . . . 0.0 111.733 178.413 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 23' ' ' THR . 50.9 m . . . . . 0 N--CA 1.394 -3.249 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.6 p -140.43 136.82 33.44 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.093 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.588 HG23 ' CE1' ' A' ' 24' ' ' PHE . 68.9 t -105.84 128.48 60.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -78.32 113.96 16.79 Favored 'General case' 0 CA--C 1.484 -1.558 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.604 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.3 p90 -135.08 138.38 43.77 Favored 'General case' 0 C--N 1.277 -2.545 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -125.04 136.59 53.83 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 118.615 -1.234 . . . . 0.0 109.788 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.46 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -88.59 170.67 10.65 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 179.432 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.8 p -66.13 -15.68 63.32 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.303 0.573 . . . . 0.0 112.051 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.5 p -94.57 -11.85 28.65 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 123.215 0.606 . . . . 0.0 111.763 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 0.9 OUTLIER -102.73 133.25 48.09 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 120.9 0.381 . . . . 0.0 110.732 -175.171 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.19 -22.82 22.6 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -127.37 170.82 12.11 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -82.37 133.57 35.23 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.549 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 20.2 m-20 -83.98 175.88 9.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 171.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -143.09 116.07 8.84 Favored 'General case' 0 C--N 1.292 -1.912 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.146 -177.651 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -95.21 125.85 47.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.1 p -93.9 123.88 37.54 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-O 121.592 0.711 . . . . 0.0 112.783 -177.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.588 ' CE1' HG23 ' A' ' 9' ' ' VAL . 22.7 p90 -136.35 176.14 8.96 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -178.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.2 148.7 30.51 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.37 -113.15 3.6 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.785 176.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -148.5 -41.32 0.16 Allowed 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -137.33 155.36 49.51 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.95 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.5 tt -126.56 131.77 70.94 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.593 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.238 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 m -63.52 140.28 58.86 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 58.4 tp -55.65 -36.68 67.32 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.566 1.146 . . . . 0.0 112.443 -176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.724 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 18.7 t -54.13 -46.86 72.29 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 13.9 t70 -74.38 -37.82 63.33 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -175.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.4 tm? -58.39 -46.97 85.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.684 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -70.06 -39.88 75.4 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.983 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.724 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -65.11 -37.08 86.33 Favored 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.515 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 89.2 mt-30 -66.36 -45.37 80.39 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.09 -41.06 81.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.911 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.5 mtm -63.95 -37.27 86.79 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.425 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.52 -44.17 41.96 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 120.283 -0.96 . . . . 0.0 111.747 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 25.5 ttt180 -64.84 -49.41 70.68 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' OE2' ' HG2' ' A' ' 41' ' ' ARG . 23.1 mm-40 -92.65 12.99 21.34 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.669 0.271 . . . . 0.0 111.72 -173.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 57.34 47.44 16.64 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.292 1.037 . . . . 0.0 112.166 176.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD2' HD13 ' A' ' 51' ' ' LEU . 9.4 mp -81.81 160.89 23.42 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.975 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -96.96 112.43 24.19 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.62 -13.38 58.03 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.06 -13.71 22.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.727 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -113.84 -38.52 4.22 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 121.768 0.794 . . . . 0.0 110.73 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.01 174.63 7.47 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.66 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.43 166.41 17.25 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 53' ' ' ILE . 28.5 tp -121.85 113.72 20.04 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -111.59 123.61 50.59 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.976 -175.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.587 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.0 mp -113.41 127.36 70.76 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -173.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.448 ' OG1' ' HG2' ' A' ' 61' ' ' GLU . 29.8 m -122.22 134.57 54.7 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.559 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.1 t-20 -62.71 140.16 58.71 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -21.37 41.42 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.232 0.539 . . . . 0.0 111.68 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -101.14 -48.27 4.47 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.712 -176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.5 p -90.74 -20.04 22.86 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.355 0.597 . . . . 0.0 109.855 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.3 mmmt 64.14 24.1 13.35 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.585 1.154 . . . . 0.0 110.928 -177.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -80.52 125.01 29.43 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.448 ' HG2' ' OG1' ' A' ' 54' ' ' THR . 44.0 mt-10 -86.12 125.72 33.68 Favored 'General case' 0 N--CA 1.402 -2.839 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.78 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HB3' HD22 ' A' ' 31' ' ' LEU . 80.3 m-85 -89.48 94.74 9.99 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.014 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -88.7 -27.35 21.29 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.954 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.99 146.9 27.65 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.691 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.656 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -69.15 -14.33 62.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.6 -10.88 59.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.102 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.81 143.31 57.95 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.448 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.65 137.55 52.57 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 118.705 0.684 . . . . 0.0 110.762 -175.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.29 118.74 35.41 Favored Pre-proline 0 C--N 1.314 -0.958 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.006 176.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 80.4 Cg_endo -82.64 161.03 16.7 Favored 'Trans proline' 0 C--N 1.326 -0.651 0 C-N-CA 123.478 2.785 . . . . 0.0 113.66 176.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.505 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 40.2 pttt -70.05 -5.84 29.46 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.737 0.779 . . . . 0.0 111.203 175.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -87.65 -1.49 57.99 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.045 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -124.42 152.91 42.7 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.971 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.9 m -116.23 133.62 55.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.3 m -127.78 156.13 39.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.506 0.67 . . . . 0.0 112.406 -174.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -101.15 128.67 53.18 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 106.622 -1.621 . . . . 0.0 106.622 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.483 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.9 t -108.77 115.29 49.03 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -116.52 126.7 53.71 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.46 -174.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -89.82 111.53 22.58 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 pp -111.01 149.99 41.26 Favored Pre-proline 0 C--N 1.297 -1.711 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo . . . . . 0 C--N 1.316 -1.136 0 C-N-CA 121.724 1.616 . . . . 0.0 112.893 -179.319 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.593 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 38.6 m . . . . . 0 N--CA 1.412 -2.358 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 64.3 m -139.5 135.45 33.51 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.389 -174.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 21' ' ' THR . 77.5 t -106.82 132.07 55.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -88.1 115.21 25.42 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 46.0 p90 -130.02 130.9 45.55 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 pttp -109.32 139.22 44.55 Favored 'General case' 0 C--N 1.3 -1.577 0 C-N-CA 116.733 -1.987 . . . . 0.0 107.355 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -84.01 165.9 18.21 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.7 m -69.77 -16.99 63.4 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.325 0.583 . . . . 0.0 110.925 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 p -90.59 -13.06 35.2 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 121.367 0.603 . . . . 0.0 110.274 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -105.45 147.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.447 0.642 . . . . 0.0 111.31 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.7 mp -96.89 -30.79 12.93 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -105.89 163.22 12.91 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.394 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -86.89 142.97 27.64 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.363 0.601 . . . . 0.0 111.789 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -108.53 177.37 4.81 Favored 'General case' 0 C--N 1.288 -2.104 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.494 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -143.67 128.05 17.86 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -174.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 1.9 m -95.79 128.61 46.83 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 172.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.423 HG22 ' SG ' ' A' ' 8' ' ' CYS . 21.8 p -94.96 122.41 37.58 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.593 ' O ' ' HB2' ' A' ' 7' ' ' SER . 21.0 p90 -140.49 171.31 14.32 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -177.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -114.06 122.24 46.27 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.51 -172.32 23.07 Favored Glycine 0 N--CA 1.43 -1.709 0 N-CA-C 108.979 -1.648 . . . . 0.0 108.979 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -96.44 -33.52 11.85 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.173 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.538 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -146.06 151.52 37.86 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.119 -177.515 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -120.29 129.49 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.413 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.968 -178.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -60.96 142.22 56.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.971 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.454 HD22 ' HB3' ' A' ' 62' ' ' TYR . 56.3 tp -55.23 -40.58 71.03 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 124.734 1.214 . . . . 0.0 111.389 -177.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 65' ' ' ASP . 36.0 t -54.14 -46.44 72.23 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.528 0.518 . . . . 0.0 109.808 178.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.1 t70 -74.9 -41.05 60.48 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.861 -176.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -60.53 -44.18 96.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.175 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 51.0 mtmt -65.37 -38.62 90.6 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.436 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 6.0 mptp? -61.63 -37.93 85.78 Favored 'General case' 0 C--O 1.243 0.75 0 O-C-N 123.012 0.195 . . . . 0.0 110.859 177.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 67.6 mm-40 -67.22 -50.39 60.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.14 -43.76 84.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.133 -176.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.9 mtm -63.97 -39.51 94.3 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 122.273 -0.267 . . . . 0.0 111.047 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -42.28 74.23 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.386 177.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.61 -46.46 75.79 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -92.07 2.34 56.63 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt 65.33 53.55 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 124.946 1.298 . . . . 0.0 111.051 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.81 158.26 18.2 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.203 177.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -93.91 100.78 12.88 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-O 122.153 0.978 . . . . 0.0 109.172 175.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.31 60.33 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.991 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.42 -12.25 32.69 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.043 0.449 . . . . 0.0 111.447 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -105.45 -39.76 6.03 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.203 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.11 177.14 7.52 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.733 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.442 ' HB3' HD11 ' A' ' 80' ' ' ILE . 3.3 t70 -127.51 171.17 11.84 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 -178.274 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 18.2 tp -118.41 125.46 50.02 Favored 'General case' 0 C--N 1.275 -2.667 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.605 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.8 tt0 -114.02 121.94 45.39 Favored 'General case' 0 C--N 1.29 -2.0 0 O-C-N 121.831 -0.543 . . . . 0.0 110.216 -175.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.425 HG13 HG22 ' A' ' 77' ' ' VAL . 2.0 mp -114.08 127.64 71.4 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.977 0 CA-C-O 120.969 0.414 . . . . 0.0 110.809 -175.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.9 m -111.21 144.61 40.09 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.538 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.0 t-20 -80.85 131.39 35.38 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.55 -11.07 58.7 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 120.963 0.411 . . . . 0.0 111.456 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -105.92 -47.92 3.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.006 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.6 p -89.68 -19.19 25.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt 71.85 14.55 5.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.456 1.502 . . . . 0.0 110.678 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -80.68 131.33 35.45 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -95.11 126.75 40.66 Favored 'General case' 0 N--CA 1.408 -2.53 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.49 ' CD1' ' HB1' ' A' ' 67' ' ' ALA . 32.6 m-85 -90.51 101.93 14.66 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -177.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.9 p -101.01 -22.22 14.81 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.161 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.03 147.61 26.74 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -76.32 -7.83 55.79 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.74 -10.91 58.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.49 ' HB1' ' CD1' ' A' ' 62' ' ' TYR . . . -62.2 141.46 58.18 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.12 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.538 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -117.53 138.42 51.91 Favored 'General case' 0 C--N 1.29 -2.018 0 O-C-N 121.908 -0.495 . . . . 0.0 111.437 -174.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.27 115.69 42.44 Favored Pre-proline 0 C--N 1.309 -1.162 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.441 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.51 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 54.7 Cg_endo -80.25 153.43 21.41 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.988 2.458 . . . . 0.0 113.592 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 16.1 ptmt -60.35 -20.27 58.79 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.852 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -75.31 -19.56 59.57 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.164 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.414 ' OG ' ' HG2' ' A' ' 70' ' ' PRO . 24.7 m -104.32 139.39 39.37 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-O 121.588 0.709 . . . . 0.0 112.455 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.3 m -97.89 129.38 44.83 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 171.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -123.95 164.39 22.11 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.5 mt -120.93 130.15 74.95 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 53' ' ' ILE . 23.1 t -102.27 124.39 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.772 -173.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -120.33 145.03 47.52 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.0 ttm105 -100.68 125.85 47.15 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.605 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -129.49 156.29 78.83 Favored Pre-proline 0 C--O 1.217 -0.639 0 C-N-CA 121.249 -0.18 . . . . 0.0 110.83 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo . . . . . 0 CA--C 1.537 0.626 0 C-N-CA 122.079 1.852 . . . . 0.0 110.318 175.537 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.6 m . . . . . 0 N--CA 1.407 -2.591 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.5 p -148.43 143.33 26.7 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.834 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.481 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.6 t -106.26 131.94 54.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -77.56 112.32 14.22 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 124.056 0.848 . . . . 0.0 108.749 174.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.637 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -132.31 141.47 48.98 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -120.54 142.46 49.31 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 117.77 -1.572 . . . . 0.0 108.473 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.555 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -84.5 157.38 21.32 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 176.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -55.58 -31.0 61.82 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.254 0.622 . . . . 0.0 112.601 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -122.43 16.63 10.51 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.123 0.487 . . . . 0.0 111.106 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 16.1 tptm -86.13 -29.03 23.61 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.6 tp 74.04 -52.78 0.69 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.102 1.761 . . . . 0.0 112.174 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -98.75 152.61 19.49 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.081 -178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -74.95 142.86 43.9 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.915 0.864 . . . . 0.0 112.274 -178.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -115.24 178.74 4.18 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -140.4 117.36 11.11 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 120.866 0.365 . . . . 0.0 110.289 -174.522 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 13.0 p -95.37 118.7 42.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.4 p -85.66 127.33 34.46 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.974 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 7' ' ' SER . 32.9 p90 -142.35 176.29 9.11 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -114.68 144.67 43.06 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.26 -179.14 19.8 Favored Glycine 0 C--N 1.306 -1.137 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -175.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -87.22 -33.36 19.35 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 118.03 0.915 . . . . 0.0 109.068 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.536 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -138.1 159.88 40.87 Favored 'General case' 0 CA--C 1.484 -1.576 0 CA-C-N 114.746 -1.116 . . . . 0.0 112.119 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.2 tt -128.28 128.53 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.098 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.536 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.6 m -62.66 147.03 50.65 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.256 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.73 -42.19 88.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 123.972 0.909 . . . . 0.0 112.697 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.586 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 33.7 t -56.5 -45.55 80.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.46 -45.78 82.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.909 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.36 -46.57 82.85 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.912 -176.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.8 mtmt -64.17 -41.18 97.24 Favored 'General case' 0 C--O 1.207 -1.139 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -62.94 -37.24 86.25 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -62.59 -50.62 70.54 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.025 0.441 . . . . 0.0 109.831 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.77 -47.8 68.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.87 -176.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.417 ' HG3' HD22 ' A' ' 51' ' ' LEU . 71.6 mtm -65.8 -33.59 76.21 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.43 35.71 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 119.211 -1.471 . . . . 0.0 111.16 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -59.63 -50.86 72.22 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.521 0.728 . . . . 0.0 111.931 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 7.7 mm-40 -92.72 0.22 57.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.266 0.555 . . . . 0.0 110.338 -174.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 60.75 70.93 0.59 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.69 1.196 . . . . 0.0 112.686 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.473 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.3 mp -103.97 144.2 31.84 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.526 -1.216 . . . . 0.0 108.899 175.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 7.0 ptpp? -92.9 103.49 15.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.972 0.892 . . . . 0.0 111.331 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.95 -16.48 62.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.43 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.04 1.75 51.88 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.308 0.575 . . . . 0.0 110.994 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 26.0 t70 -122.16 -36.72 2.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.608 0.718 . . . . 0.0 109.955 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -135.44 153.61 51.72 Favored 'General case' 0 N--CA 1.42 -1.951 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.717 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -108.6 159.92 16.34 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.6 tp -107.68 107.95 18.98 Favored 'General case' 0 C--N 1.267 -2.989 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HB2' HG12 ' A' ' 80' ' ' ILE . 31.8 tt0 -103.43 108.96 20.42 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.908 0.861 . . . . 0.0 109.123 -173.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.484 HD12 HG22 ' A' ' 77' ' ' VAL . 25.3 mm -94.56 135.42 28.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.314 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 24.3 m -118.8 149.33 41.69 Favored 'General case' 0 C--N 1.281 -2.4 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.502 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.7 t-20 -72.49 139.69 47.79 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.45 -26.25 51.3 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.144 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -92.74 -58.15 2.44 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.449 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.9 p -87.94 -16.61 33.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.152 0.501 . . . . 0.0 110.67 -171.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 63.71 21.79 12.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.091 0.956 . . . . 0.0 111.489 -177.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -75.46 130.4 38.86 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.1 mt-10 -87.44 137.49 32.29 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-O 121.097 0.475 . . . . 0.0 110.665 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -103.77 103.0 12.84 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -106.39 -19.96 13.53 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.922 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -90.21 133.62 34.8 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.502 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.5 m-20 -66.96 -13.25 61.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 120.801 0.334 . . . . 0.0 111.881 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -85.43 -6.19 59.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.32 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.28 141.77 58.64 Favored 'General case' 0 C--O 1.208 -1.117 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.536 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.96 137.63 52.71 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -177.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.72 115.45 35.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.278 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -77.71 155.85 31.28 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.042 2.495 . . . . 0.0 113.254 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 53.5 pttt -69.71 -8.14 45.3 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.536 0.684 . . . . 0.0 111.447 178.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -81.56 -17.7 47.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.383 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.5 m -105.71 158.72 16.52 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.879 -177.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 m -119.62 136.86 54.21 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.637 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -130.9 166.24 29.09 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 CA-C-O 121.078 0.466 . . . . 0.0 111.102 -175.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.5 mt -120.03 130.57 74.11 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.484 HG22 HD12 ' A' ' 53' ' ' ILE . 57.6 t -102.01 122.47 54.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.005 -173.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -127.51 128.13 45.16 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 47.6 ttp180 -88.1 125.85 34.8 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.495 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -122.68 142.18 36.98 Favored Pre-proline 0 N--CA 1.439 -0.988 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 C--N 1.31 -1.481 0 C-N-CA 122.261 1.974 . . . . 0.0 110.847 178.154 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.8 m . . . . . 0 N--CA 1.403 -2.795 0 CA-C-O 120.983 0.42 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 14.5 p -146.37 140.19 26.18 Favored 'General case' 0 N--CA 1.418 -2.043 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.513 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.537 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.9 t -107.74 124.66 63.98 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.256 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -73.62 105.35 4.91 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 124.203 0.939 . . . . 0.0 108.893 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -124.97 133.39 53.03 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -108.31 134.73 50.73 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 117.205 -1.798 . . . . 0.0 108.283 174.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 1.2 t80 -97.88 161.79 13.56 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.161 -2.162 . . . . 0.0 105.161 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 t -59.71 -26.29 65.5 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 t -87.86 -12.0 46.12 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.175 0.512 . . . . 0.0 110.833 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 2.8 mptp? -96.18 133.09 40.91 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 177.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.68 -22.76 25.89 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.3 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.505 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 18.7 m120 -120.42 168.62 11.12 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.572 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -76.5 144.67 39.64 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.644 0.735 . . . . 0.0 112.122 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -104.85 177.88 4.72 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -141.77 113.68 7.96 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 118.716 0.689 . . . . 0.0 112.006 -174.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.61 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.16 136.61 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.9 p -108.24 145.47 34.26 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -174.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.537 ' HE1' HG23 ' A' ' 9' ' ' VAL . 30.1 p90 -158.71 157.36 31.63 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.12 115.35 28.84 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 118.224 0.465 . . . . 0.0 109.78 175.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.23 175.6 14.97 Favored Glycine 0 C--N 1.284 -2.345 0 N-CA-C 108.205 -1.958 . . . . 0.0 108.205 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.0 tp -85.43 -32.86 22.1 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 118.409 1.105 . . . . 0.0 110.774 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -145.5 151.24 37.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -177.247 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.9 131.37 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.039 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.622 -177.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.1 m -61.84 148.05 44.55 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 123.122 0.569 . . . . 0.0 110.376 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 124.059 0.944 . . . . 0.0 111.394 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.63 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 49.5 t -55.59 -46.13 77.32 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -69.71 -44.33 70.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.261 0.553 . . . . 0.0 110.289 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.43 -45.82 89.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.09 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.0 mtmt -62.7 -42.96 99.91 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.922 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.3 mptp? -61.47 -35.44 77.64 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 120.753 0.311 . . . . 0.0 111.123 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -69.85 -42.71 73.19 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.455 ' O ' ' HB3' ' A' ' 41' ' ' ARG . 66.3 mt -74.34 -36.21 41.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.691 0.281 . . . . 0.0 111.444 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.505 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.5 mtt -62.45 -46.0 90.49 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.83 -38.67 93.16 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.258 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 25.8 tpt180 -54.62 -50.24 68.57 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.552 1.541 . . . . 0.0 110.925 178.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 67.1 mm-40 -100.58 6.29 44.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -176.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.407 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 63.96 36.23 10.21 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.591 0.756 . . . . 0.0 111.999 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.435 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.3 mp -66.74 154.05 41.72 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.599 0.714 . . . . 0.0 112.382 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 19.9 ptmt -98.44 106.88 19.22 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.652 173.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.83 -6.06 55.06 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.231 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.96 -5.5 59.23 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.904 177.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.508 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 17.9 t70 -128.88 -42.36 1.41 Allowed 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.511 0.672 . . . . 0.0 109.756 176.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.5 m -120.62 157.58 29.23 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -113.46 169.34 9.03 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' HD11 ' A' ' 53' ' ' ILE . 15.7 tp -119.62 113.41 20.65 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 119.756 -0.778 . . . . 0.0 108.953 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.627 HE21 HG21 ' A' ' 80' ' ' ILE . 9.3 tt0 -106.53 120.5 42.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.049 -177.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.471 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.1 mm -106.5 135.68 43.96 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.7 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 23.4 m -117.28 151.06 37.73 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 175.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.596 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -78.03 145.71 35.75 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 175.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.29 -21.86 24.2 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.304 0.573 . . . . 0.0 110.861 -178.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -96.75 -48.87 5.31 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.579 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 35.9 p -93.77 -21.89 19.03 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.02 0.438 . . . . 0.0 110.353 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 68.3 19.36 9.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.037 1.335 . . . . 0.0 112.139 -175.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.51 125.8 27.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.9 mt-10 -87.73 127.48 35.31 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.224 0.535 . . . . 0.0 110.785 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -93.04 100.95 13.28 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.0 p -99.19 -35.86 9.85 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.646 -176.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -85.88 135.71 33.59 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -66.8 -12.45 58.96 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -90.91 -1.42 57.84 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.867 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.92 148.29 51.77 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.62 137.63 53.14 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 118.393 0.542 . . . . 0.0 110.689 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -115.87 118.45 38.58 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.968 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.41 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 83.3 Cg_endo -83.62 157.5 14.18 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.097 2.532 . . . . 0.0 112.982 176.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.74 3.26 5.3 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 122.495 1.141 . . . . 0.0 110.78 176.462 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -87.68 -18.55 29.28 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.05 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.7 m -116.31 151.59 35.56 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.355 0.598 . . . . 0.0 111.74 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.2 t -105.96 137.63 43.53 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 176.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -128.46 159.65 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-O 121.648 0.737 . . . . 0.0 112.781 -177.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.3 mm -109.42 126.29 66.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.452 HG22 HD12 ' A' ' 53' ' ' ILE . 61.4 t -101.4 123.26 54.38 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.283 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 ttp-105 -122.94 124.48 43.29 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.225 0.536 . . . . 0.0 109.856 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -83.59 120.33 25.83 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.627 HG21 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -124.66 153.84 70.06 Favored Pre-proline 0 C--O 1.201 -1.471 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 CA--C 1.538 0.699 0 C-N-CA 122.07 1.847 . . . . 0.0 111.947 179.592 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' THR . 70.8 m . . . . . 0 N--CA 1.397 -3.099 0 CA-C-O 121.673 0.749 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.2 p -140.38 132.79 28.45 Favored 'General case' 0 N--CA 1.399 -3.023 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.04 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.595 HG23 ' HE1' ' A' ' 24' ' ' PHE . 43.5 t -107.11 127.96 62.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 62.7 m-70 -79.66 105.64 11.1 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 174.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.2 p90 -118.0 142.3 47.52 Favored 'General case' 0 C--N 1.28 -2.426 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -123.65 124.27 42.39 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 118.77 -1.172 . . . . 0.0 110.199 174.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -80.32 157.89 26.26 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 177.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 m -56.89 -37.68 71.72 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.042 0.448 . . . . 0.0 110.229 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 p -88.06 -8.59 55.32 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.43 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 31.5 tptt -83.37 -37.73 22.93 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 tt 73.65 -51.78 0.7 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 125.726 1.61 . . . . 0.0 109.571 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -100.18 170.01 8.75 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -88.2 155.66 19.64 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.22 0.533 . . . . 0.0 111.095 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.6 t70 -128.33 178.53 6.2 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -133.78 117.88 17.4 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 119.366 0.984 . . . . 0.0 112.258 -173.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.4 p -99.9 123.14 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.7 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 7' ' ' SER . 36.1 p -92.03 143.06 26.85 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.968 -177.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HE1' HG23 ' A' ' 9' ' ' VAL . 41.4 p90 -154.6 172.23 18.18 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.681 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.59 133.0 43.56 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.229 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.85 178.59 21.58 Favored Glycine 0 C--N 1.292 -1.915 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.03 -33.96 19.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -137.78 164.1 29.74 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.011 -179.15 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.0 tt -134.1 131.08 55.44 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.548 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m -63.58 143.16 58.06 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.9 tp -54.54 -40.08 68.32 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.27 1.428 . . . . 0.0 113.351 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.533 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.5 t -55.96 -45.89 78.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.719 0.295 . . . . 0.0 110.539 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.88 -41.73 70.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.26 -46.13 85.05 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.978 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.7 mtmt -61.73 -42.56 99.12 Favored 'General case' 0 C--O 1.206 -1.199 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.45 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.75 -35.11 77.15 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.27 0.356 . . . . 0.0 111.849 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -70.64 -45.68 64.72 Favored 'General case' 0 C--O 1.21 -1.009 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.109 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.4 -38.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.846 0.355 . . . . 0.0 111.348 -178.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.5 mtt -63.7 -38.99 93.2 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.6 -31.8 60.24 Favored Glycine 0 C--O 1.219 -0.833 0 N-CA-C 111.771 -0.531 . . . . 0.0 111.771 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.507 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 24.9 tpt180 -64.59 -51.36 63.15 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 124.818 1.247 . . . . 0.0 110.865 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -94.63 -17.95 21.82 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 80.4 70.14 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 125.811 1.645 . . . . 0.0 111.825 -176.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -97.55 165.93 11.75 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 114.803 -1.089 . . . . 0.0 111.793 176.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -107.19 101.79 11.16 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.235 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.77 -13.98 60.66 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.925 -173.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.52 2.38 56.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.721 0.772 . . . . 0.0 110.374 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -119.21 -36.26 3.42 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.742 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.3 p -139.22 162.48 34.89 Favored 'General case' 0 C--N 1.297 -1.695 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.806 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.405 ' HB3' HD11 ' A' ' 80' ' ' ILE . 40.4 t0 -114.6 166.58 11.58 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HG ' HD11 ' A' ' 53' ' ' ILE . 16.1 tp -117.33 105.54 12.28 Favored 'General case' 0 C--N 1.263 -3.153 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -174.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.439 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.6 tp60 -90.93 123.42 34.41 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 -175.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.427 HD11 ' HG ' ' A' ' 51' ' ' LEU . 27.8 mm -110.84 135.22 50.62 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.571 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.0 m -123.19 140.73 52.72 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.9 t-20 -71.52 139.68 49.62 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -29.66 55.88 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.631 0.729 . . . . 0.0 110.687 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -94.32 -49.64 5.62 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.127 -173.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.4 p -93.18 -18.23 22.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.291 0.567 . . . . 0.0 109.475 -175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 42.0 mmtm 65.15 22.55 12.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.603 1.161 . . . . 0.0 112.242 -177.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -78.06 129.26 35.02 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -83.73 136.89 34.0 Favored 'General case' 0 N--CA 1.412 -2.373 0 CA-C-O 121.336 0.588 . . . . 0.0 109.595 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.44 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 89.7 m-85 -96.13 98.73 10.57 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 3.2 p -91.8 -40.98 10.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -175.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -91.87 147.45 22.96 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 13.5 m-20 -66.06 -16.03 63.58 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.887 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -88.96 -1.33 58.05 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.201 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.44 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -66.42 145.4 55.72 Favored 'General case' 0 C--O 1.209 -1.076 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.06 137.73 52.71 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 119.928 -0.709 . . . . 0.0 112.696 -172.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.13 117.97 40.75 Favored Pre-proline 0 C--N 1.312 -1.024 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.87 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 64.4 Cg_endo -81.83 154.48 17.58 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.083 2.522 . . . . 0.0 112.827 174.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.557 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.17 -10.72 56.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -87.76 -2.05 58.36 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.319 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 55.2 m -106.92 140.0 40.42 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.302 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 m -100.0 131.67 45.82 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 172.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 55' ' ' ASN . 27.0 m -125.88 159.86 33.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -176.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 mm -105.07 135.34 43.5 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 45.5 t -111.73 117.66 55.67 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-O 120.973 0.416 . . . . 0.0 110.085 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -119.38 122.9 42.84 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.407 0.683 . . . . 0.0 109.993 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -77.97 121.6 24.41 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.439 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.37 146.72 45.55 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.867 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--N 1.313 -1.322 0 C-N-CA 122.344 2.029 . . . . 0.0 111.043 178.0 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.586 ' O ' ' HA ' ' A' ' 23' ' ' THR . 3.3 m . . . . . 0 N--CA 1.416 -2.142 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.3 p -138.11 134.17 34.31 Favored 'General case' 0 N--CA 1.419 -2.007 0 C-N-CA 119.542 -0.863 . . . . 0.0 111.855 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' CE1' ' A' ' 24' ' ' PHE . 74.5 t -106.67 125.59 62.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 175.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -77.82 119.75 21.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.658 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 43.1 p90 -133.98 138.55 45.51 Favored 'General case' 0 C--N 1.286 -2.176 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -118.46 146.12 44.73 Favored 'General case' 0 N--CA 1.426 -1.649 0 C-N-CA 118.433 -1.307 . . . . 0.0 107.678 173.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -92.87 169.4 10.49 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -63.7 -16.68 61.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.901 0.857 . . . . 0.0 110.708 174.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.0 m -138.15 107.85 6.25 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 171.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -177.81 -39.23 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.0 tp 76.71 -52.53 0.58 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.905 1.682 . . . . 0.0 111.136 -178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -102.01 172.65 6.79 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -94.99 143.38 26.52 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-O 121.24 0.543 . . . . 0.0 109.672 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -104.6 177.76 4.75 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 175.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.13 116.29 9.44 Favored 'General case' 0 C--N 1.275 -2.642 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -173.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 15.0 p -95.16 116.94 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.782 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.586 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.2 p -89.42 124.36 34.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.587 0.708 . . . . 0.0 112.201 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.461 ' CE1' HG23 ' A' ' 9' ' ' VAL . 31.6 p90 -132.92 177.17 7.86 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -176.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -113.8 136.1 53.23 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.95 174.48 17.17 Favored Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -82.12 -35.58 28.38 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.503 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -135.08 159.24 42.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -179.753 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.4 tt -127.4 126.14 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.572 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.0 m -59.74 141.36 55.35 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.957 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.459 HD11 ' CG1' ' A' ' 53' ' ' ILE . 56.8 tp -55.24 -40.91 71.43 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 123.973 0.909 . . . . 0.0 112.045 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.734 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 9.3 t -56.3 -46.66 79.71 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.8 t70 -68.05 -43.92 77.57 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 -177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.22 -46.61 89.71 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.883 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 44.2 mtmt -67.13 -40.48 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.707 0.289 . . . . 0.0 110.645 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.3 mptt -65.03 -34.09 77.61 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.093 178.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.6 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 83.2 mm-40 -62.13 -49.95 73.84 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.353 0.596 . . . . 0.0 109.495 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.3 mt -67.76 -47.85 78.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.627 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.1 mtm -63.33 -37.24 86.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.853 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.43 61.89 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.154 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -72.39 -49.55 33.01 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 122.628 0.371 . . . . 0.0 111.548 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 44.2 mt-10 -93.45 -1.74 55.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 18.9 mmtp 71.75 45.02 0.45 Allowed 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.411 1.085 . . . . 0.0 111.225 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.7 mp -73.34 162.99 28.71 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.942 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.46 100.28 12.86 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.133 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.07 -14.73 58.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.887 -173.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.68 -4.39 23.83 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.878 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -103.1 -42.55 5.74 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.972 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.4 m -133.65 166.17 23.24 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.7 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -108.13 162.14 14.33 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.524 HD11 ' CG1' ' A' ' 77' ' ' VAL . 33.1 tp -107.44 125.05 50.75 Favored 'General case' 0 C--N 1.251 -3.674 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.603 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.2 tt0 -110.67 128.93 55.91 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 -178.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.7 mm -113.31 133.62 58.62 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -176.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 22.8 m -116.71 153.39 32.46 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 176.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -83.86 146.51 28.05 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.08 -12.45 28.48 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.267 0.556 . . . . 0.0 111.187 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -103.76 -39.64 6.58 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.096 -176.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -100.04 -25.11 14.42 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.8 mmmm 68.84 24.93 6.33 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.099 1.359 . . . . 0.0 111.131 -176.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -90.24 135.51 33.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.731 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 18.4 mp0 -78.81 141.53 37.67 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 121.043 0.449 . . . . 0.0 110.959 175.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -103.21 99.4 9.25 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 173.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 p -82.22 -31.18 30.42 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' HD23 ' A' ' 31' ' ' LEU . 2.2 m-20 -105.87 139.42 40.46 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.608 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -63.19 -7.25 5.51 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.066 0.946 . . . . 0.0 111.454 178.179 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -90.63 -0.16 57.59 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.368 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.04 152.05 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.503 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.76 137.35 53.42 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 118.21 0.459 . . . . 0.0 110.36 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -116.34 117.3 38.75 Favored Pre-proline 0 C--N 1.304 -1.386 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.652 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.7 Cg_endo -79.77 159.7 24.72 Favored 'Trans proline' 0 C--N 1.323 -0.779 0 C-N-CA 122.936 2.424 . . . . 0.0 112.683 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.1 pttt -70.59 1.01 5.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.486 0.66 . . . . 0.0 111.327 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -87.81 -11.26 48.49 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.8 m -122.21 149.35 43.79 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 121.389 0.614 . . . . 0.0 112.56 -172.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 m -103.43 133.28 48.75 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 19.2 m -126.25 169.78 17.18 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 CA-C-O 120.924 0.392 . . . . 0.0 111.026 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mt -123.95 136.11 61.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 123.704 0.802 . . . . 0.0 109.012 -177.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.524 ' CG1' HD11 ' A' ' 51' ' ' LEU . 26.3 t -106.23 128.58 60.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.472 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -136.73 133.4 36.04 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -89.62 132.42 35.13 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.603 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -131.44 152.65 80.85 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 118.215 0.461 . . . . 0.0 110.318 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo . . . . . 0 C--O 1.242 0.72 0 C-N-CA 121.795 1.663 . . . . 0.0 110.875 177.184 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HA ' ' A' ' 23' ' ' THR . 41.9 m . . . . . 0 N--CA 1.415 -2.196 0 CA-C-O 120.78 0.324 . . . . 0.0 111.797 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.608 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.1 p -148.53 135.19 19.78 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.357 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.584 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.3 t -107.06 134.43 48.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -84.0 109.68 17.83 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -127.82 138.97 52.9 Favored 'General case' 0 C--N 1.277 -2.555 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -121.03 137.52 54.61 Favored 'General case' 0 C--N 1.281 -2.398 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.4 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.5 t80 -90.42 156.77 17.98 Favored 'General case' 0 C--N 1.283 -2.29 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.6 m -56.92 -29.19 62.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.899 0.381 . . . . 0.0 111.007 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.6 m -83.76 -10.96 57.74 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.311 0.644 . . . . 0.0 111.813 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -101.19 156.98 17.11 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 122.107 -0.37 . . . . 0.0 110.873 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.9 mt -97.56 -43.24 7.31 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.736 0.779 . . . . 0.0 108.949 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -114.54 167.64 10.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.394 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -76.12 149.1 37.44 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.948 0.88 . . . . 0.0 112.779 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -112.16 177.11 4.75 Favored 'General case' 0 C--N 1.28 -2.441 0 N-CA-C 105.126 -2.175 . . . . 0.0 105.126 174.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -140.18 113.53 8.49 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 118.612 0.642 . . . . 0.0 110.354 -174.035 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 12.2 p -96.3 124.07 48.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.402 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.527 ' HA ' ' O ' ' A' ' 7' ' ' SER . 13.3 p -87.3 140.07 29.92 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.648 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.584 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.0 p90 -148.08 167.36 25.18 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 120.987 0.423 . . . . 0.0 110.736 -178.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -101.63 116.15 32.1 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.611 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.42 177.07 15.46 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 110.435 -1.066 . . . . 0.0 110.435 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.3 tp -77.52 -30.98 53.14 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 122.021 0.915 . . . . 0.0 109.529 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.61 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.76 158.72 43.46 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.533 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 tt -124.53 128.1 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.103 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 m -62.1 142.3 57.65 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.944 175.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 58.2 tp -54.41 -39.87 67.71 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 125.301 1.441 . . . . 0.0 112.262 -176.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.557 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -55.83 -46.19 78.18 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 123.24 0.337 . . . . 0.0 110.602 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.1 t70 -73.34 -39.08 65.49 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -175.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.76 -46.19 89.19 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.05 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 53.4 mtmt -66.32 -39.76 89.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.0 mptp? -61.71 -40.35 94.72 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.275 178.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 64.6 mt-30 -66.9 -50.32 62.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.445 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.72 -43.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.631 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.55 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 71.1 mtm -64.27 -45.07 89.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.74 -178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.38 -33.89 61.09 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.965 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 41' ' ' ARG . 35.3 ttt180 -75.09 -46.75 32.56 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 32.2 mm-40 -94.24 13.13 24.36 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp 68.16 34.04 4.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.518 1.127 . . . . 0.0 111.873 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 10.5 mp -74.62 174.19 9.39 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.172 0.987 . . . . 0.0 112.819 -178.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.613 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 13.2 ptpt -109.82 108.28 18.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.618 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.37 -20.71 31.52 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -175.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -107.04 -15.13 14.76 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.947 0.403 . . . . 0.0 111.343 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.613 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 14.4 t70 -92.56 -27.66 17.23 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -176.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -147.94 167.51 24.66 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -110.87 169.5 8.72 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.472 HD11 HG12 ' A' ' 77' ' ' VAL . 31.2 tp -127.52 119.78 26.8 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -175.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HB2' HG12 ' A' ' 80' ' ' ILE . 39.4 tt0 -121.63 136.98 54.92 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -115.39 135.62 54.79 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.904 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -176.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 m -121.51 146.03 47.35 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.541 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -74.64 137.22 42.1 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.77 43.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.364 0.602 . . . . 0.0 111.205 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -100.06 -52.84 3.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.929 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.3 p -92.23 -16.59 25.97 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.6 mmmm 68.41 17.13 9.19 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.749 1.219 . . . . 0.0 111.463 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -81.4 132.42 35.32 Favored 'General case' 0 N--CA 1.433 -1.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -83.85 146.71 27.95 Favored 'General case' 0 N--CA 1.415 -2.195 0 CA-C-O 121.577 0.703 . . . . 0.0 110.416 178.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 79.7 m-85 -107.22 103.83 13.3 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -100.38 -36.99 9.04 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -88.61 140.01 29.89 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.546 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 2.0 m-20 -68.61 -10.79 58.17 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -88.83 -4.45 58.49 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.035 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.424 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -63.73 142.89 58.24 Favored 'General case' 0 C--O 1.208 -1.095 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.61 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -117.14 137.79 52.08 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.586 -173.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.62 117.87 37.54 Favored Pre-proline 0 C--N 1.306 -1.323 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 91.2 Cg_endo -81.3 160.22 20.09 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 123.233 2.622 . . . . 0.0 114.063 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -67.96 -9.19 43.37 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.889 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -87.91 -1.57 58.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.423 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.9 m -121.01 157.34 30.2 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 121.406 0.622 . . . . 0.0 112.233 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 m -115.06 130.83 57.03 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 174.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.4 m -127.26 160.22 36.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.46 0.647 . . . . 0.0 112.694 -175.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.4 mm -104.0 123.86 58.01 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 51' ' ' LEU . 40.6 t -104.43 120.12 54.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -127.13 130.51 49.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.239 -172.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -83.52 120.93 26.54 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.63 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -117.59 156.62 49.22 Favored Pre-proline 0 C--N 1.313 -0.985 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.735 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 26.0 Cg_endo . . . . . 0 N--CA 1.453 -0.86 0 C-N-CA 122.231 1.954 . . . . 0.0 112.798 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.669 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 50.3 m . . . . . 0 N--CA 1.422 -1.845 0 CA-C-O 121.28 0.562 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.0 p -132.95 135.72 45.69 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.85 -177.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG23 ' HE1' ' A' ' 24' ' ' PHE . 40.8 t -110.29 126.61 67.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -82.4 111.34 18.36 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.635 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.2 p90 -127.36 139.91 52.54 Favored 'General case' 0 C--N 1.28 -2.44 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -123.1 139.28 54.24 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.001 -1.48 . . . . 0.0 107.876 174.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -78.7 171.23 15.45 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -57.77 -37.54 73.85 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 123.28 0.632 . . . . 0.0 111.867 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.7 m -102.22 9.78 39.79 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-O 121.067 0.46 . . . . 0.0 111.918 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -92.71 135.19 34.32 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.2 mt -96.79 -24.12 16.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.428 0.632 . . . . 0.0 109.796 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -107.13 165.18 11.55 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -92.63 138.59 31.37 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.289 0.566 . . . . 0.0 110.219 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 173.24 7.79 Favored 'General case' 0 C--N 1.281 -2.37 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 175.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.51 128.95 30.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -111.86 138.89 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.222 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 176.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -116.7 143.84 45.15 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.1 p90 -153.7 176.81 11.68 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -125.81 130.56 51.65 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.403 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.34 -114.63 1.19 Allowed Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -140.9 -45.75 0.39 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.593 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -141.5 158.45 43.83 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -177.36 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -125.43 129.78 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.289 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -63.86 149.52 46.85 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 122.881 0.472 . . . . 0.0 110.471 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 43.2 tp -57.61 -44.75 85.7 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.544 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 50.4 t -56.64 -45.51 81.53 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.953 177.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.96 -42.31 94.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.416 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -62.67 -47.47 83.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.267 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.6 mtmt -67.21 -41.82 85.13 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.275 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -61.7 -35.18 77.3 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -69.1 -49.15 59.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 0.0 110.546 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.2 mt -69.56 -44.09 79.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.311 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.461 ' HG2' HD22 ' A' ' 44' ' ' LEU . 72.3 mtm -62.94 -37.34 86.66 Favored 'General case' 0 CA--C 1.51 -0.591 0 O-C-N 122.23 -0.294 . . . . 0.0 111.34 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.94 -41.58 87.52 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -66.89 -38.07 85.59 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 123.079 0.551 . . . . 0.0 112.119 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.96 11.87 37.83 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.967 0.413 . . . . 0.0 111.158 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? 59.34 38.36 23.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.513 172.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.461 HD22 ' HG2' ' A' ' 39' ' ' MET . 9.2 mp -73.13 152.91 40.98 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -83.85 100.48 10.99 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.36 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.41 -8.3 59.41 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.195 -173.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 6.69 42.59 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.155 0.503 . . . . 0.0 109.993 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -130.23 -40.84 1.28 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.403 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.78 172.54 9.23 Favored 'General case' 0 N--CA 1.418 -2.059 0 CA-C-O 121.552 0.691 . . . . 0.0 111.241 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -126.3 166.74 16.57 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.9 tp -111.32 118.29 35.48 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.503 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.4 tp60 -104.51 126.13 51.31 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.422 HD12 HG22 ' A' ' 77' ' ' VAL . 30.3 mm -108.92 135.23 48.44 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -176.047 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.7 m -127.17 136.68 52.41 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.531 ' HA ' HG12 ' A' ' 75' ' ' VAL . 12.3 t-20 -64.97 135.09 55.25 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 117.892 0.314 . . . . 0.0 110.3 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.9 -23.26 58.34 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.228 0.537 . . . . 0.0 110.786 -178.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -94.98 -55.81 2.96 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.874 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -92.72 -15.78 26.26 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.891 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.95 21.23 12.54 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.537 0.735 . . . . 0.0 112.458 -174.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -71.96 117.86 14.1 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -81.52 138.91 35.4 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.07 96.98 7.59 Favored 'General case' 0 C--N 1.274 -2.712 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.2 p -94.59 -20.02 19.98 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.742 -175.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.64 129.46 45.78 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.574 -174.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -71.22 -7.59 47.86 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.709 0.686 . . . . 0.0 112.191 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -93.07 2.15 56.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.27 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.31 147.64 49.41 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 175.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.593 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.54 138.35 51.96 Favored 'General case' 0 C--N 1.28 -2.428 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.685 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -113.96 114.33 46.47 Favored Pre-proline 0 C--N 1.307 -1.279 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.858 175.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.518 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.3 Cg_endo -77.75 161.28 30.68 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.097 2.532 . . . . 0.0 112.806 175.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.669 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 19.9 pttm -66.92 -8.86 32.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.789 0.804 . . . . 0.0 111.219 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.61 -3.22 58.98 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.497 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.2 m -114.72 125.48 53.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 120.903 0.382 . . . . 0.0 111.404 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.0 m -90.26 123.58 34.16 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 23.6 m -123.54 155.12 29.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.431 0.634 . . . . 0.0 112.598 -175.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.26 132.23 48.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.495 ' CG1' HD11 ' A' ' 51' ' ' LEU . 70.5 t -105.93 125.46 61.43 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.577 -176.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -131.42 145.24 51.71 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 ttp85 -99.96 126.29 46.1 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 122.051 -0.406 . . . . 0.0 109.987 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.66 155.61 66.0 Favored Pre-proline 0 C--N 1.314 -0.976 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -178.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 CA--C 1.545 1.05 0 C-N-CA 122.316 2.01 . . . . 0.0 111.94 177.064 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 N--CA 1.409 -2.482 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 18.3 p -124.07 135.42 53.55 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.437 -175.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.0 t -107.93 124.77 64.34 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.42 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 80.2 m-70 -78.04 110.59 13.12 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.518 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 31.0 p90 -128.47 141.37 51.41 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -177.151 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HE3' HD12 ' A' ' 76' ' ' ILE . 18.6 pttp -117.11 130.94 56.97 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.341 -1.344 . . . . 0.0 107.894 172.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.9 t80 -85.03 163.44 18.85 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.526 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 11.5 m -56.9 -24.99 56.09 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 123.398 0.679 . . . . 0.0 111.515 175.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.5 m -94.9 -8.58 36.72 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.537 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -112.22 124.46 52.5 Favored 'General case' 0 CA--C 1.506 -0.728 0 O-C-N 121.869 -0.519 . . . . 0.0 110.348 -176.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mp -88.92 -4.87 58.33 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.509 0.671 . . . . 0.0 110.43 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -122.22 167.43 13.22 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -91.02 143.7 26.43 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.591 0.71 . . . . 0.0 112.321 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.6 t70 -111.83 177.88 4.5 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -140.21 117.45 11.29 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 118.21 0.459 . . . . 0.0 110.951 -174.435 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.6 142.07 14.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.8 p -116.29 133.26 56.21 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -174.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.532 ' HE1' HG23 ' A' ' 9' ' ' VAL . 28.2 p90 -143.12 177.03 8.67 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.602 1.161 . . . . 0.0 107.927 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -120.62 128.35 52.94 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.01 -114.03 1.04 Allowed Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.509 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -145.02 -42.45 0.23 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.527 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.08 153.36 42.1 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.4 tt -121.53 132.42 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.852 -178.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.44 ' HB2' ' OD1' ' A' ' 33' ' ' ASP . 37.5 m -64.75 146.52 54.68 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.03 176.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 50.6 tp -57.58 -43.34 84.51 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 124.528 1.131 . . . . 0.0 113.257 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.604 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 37.4 t -56.88 -45.83 82.26 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB2' ' A' ' 30' ' ' SER . 9.0 m-20 -63.38 -47.46 81.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.663 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.56 -47.47 84.13 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.521 1.128 . . . . 0.0 110.708 -176.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.7 mtmt -69.35 -43.48 73.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.952 -178.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.604 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.9 mptp? -61.85 -39.38 91.65 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 90.8 mt-30 -64.99 -50.57 65.81 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.7 mt -63.91 -47.54 90.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.884 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.95 -33.61 76.45 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.268 -178.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.66 -43.23 36.88 Favored Glycine 0 C--N 1.312 -0.797 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.268 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -59.52 -42.46 92.29 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 125.093 1.357 . . . . 0.0 111.838 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.429 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 33.6 mt-10 -104.05 8.92 36.63 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.043 -175.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.72 64.23 1.35 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.277 175.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.445 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 10.4 mp -99.73 -176.36 3.24 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.896 177.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 18.5 ptpt -107.47 100.62 10.03 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.88 0.848 . . . . 0.0 110.423 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.56 -18.33 38.7 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.719 -176.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.63 9.21 35.73 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.908 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.459 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 23.8 t70 -133.36 -47.2 0.83 Allowed 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.762 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.9 m -112.63 176.95 4.8 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.892 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.439 ' HB3' ' CD1' ' A' ' 80' ' ' ILE . 37.2 t70 -124.09 163.08 22.21 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.3 tp -118.5 108.96 15.64 Favored 'General case' 0 N--CA 1.397 -3.104 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.3 tp-100 -91.39 120.81 32.57 Favored 'General case' 0 C--N 1.284 -2.255 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.454 HD11 ' HG ' ' A' ' 51' ' ' LEU . 35.2 mm -110.8 127.87 67.58 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.038 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -174.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 m -122.32 140.02 53.14 Favored 'General case' 0 C--N 1.268 -2.946 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.5 t-20 -65.37 131.83 47.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.87 -30.77 70.22 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.284 0.564 . . . . 0.0 110.746 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -91.48 -58.28 2.49 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.161 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.7 p -85.66 -14.94 43.99 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.038 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm 65.25 20.54 11.92 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.045 0.938 . . . . 0.0 111.685 -177.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.82 119.75 14.52 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.957 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -85.39 138.25 32.4 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-O 121.309 0.576 . . . . 0.0 109.92 177.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -100.61 90.42 4.26 Favored 'General case' 0 C--N 1.278 -2.504 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -82.48 -39.61 22.24 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.073 -175.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.538 ' HB3' ' OD1' ' A' ' 66' ' ' ASN . 6.8 m-20 -85.53 138.73 32.0 Favored 'General case' 0 CA--C 1.482 -1.638 0 CA-C-N 116.717 -0.219 . . . . 0.0 110.873 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.7 m-20 -66.57 -12.37 57.5 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.267 0.556 . . . . 0.0 111.239 -177.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.538 ' OD1' ' HB3' ' A' ' 64' ' ' ASP . 2.5 p-10 -92.87 1.01 57.51 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.43 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.86 151.64 46.32 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -118.71 138.02 52.93 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 118.137 0.426 . . . . 0.0 111.384 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.92 115.93 43.11 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.927 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 48.6 Cg_endo -75.67 153.61 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.867 2.378 . . . . 0.0 113.472 175.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HA ' HG22 ' A' ' 9' ' ' VAL . 18.0 pttp -63.67 -18.22 63.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.561 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -85.53 -4.93 59.31 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.655 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 43.5 m -116.88 139.29 50.8 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 120.906 0.384 . . . . 0.0 111.188 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 t -96.53 135.67 38.1 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -128.82 157.0 41.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 CA-C-O 121.251 0.548 . . . . 0.0 111.693 -177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 ' HE3' ' A' ' 12' ' ' LYS . 31.3 mm -102.04 132.69 47.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 11' ' ' TYR . 54.4 t -110.33 107.23 22.38 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.144 0 CA-C-O 121.442 0.639 . . . . 0.0 110.145 -175.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.526 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 12.0 tpt180 -110.34 123.7 50.33 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.199 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -81.66 122.62 27.86 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 176.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.662 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -125.81 156.59 71.04 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 120.477 0.179 . . . . 0.0 110.779 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo . . . . . 0 CA--C 1.546 1.103 0 C-N-CA 122.378 2.052 . . . . 0.0 111.11 175.818 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.605 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.1 m . . . . . 0 N--CA 1.428 -1.572 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.9 p -137.93 140.45 40.3 Favored 'General case' 0 N--CA 1.419 -2.0 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.694 -176.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.416 HG23 ' CE1' ' A' ' 24' ' ' PHE . 77.3 t -106.78 124.69 62.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -79.78 114.61 18.84 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 175.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.0 p90 -130.36 141.16 50.58 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -130.56 136.83 49.3 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.57 173.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -86.08 165.67 16.45 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -175.754 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -58.51 -31.61 68.06 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.845 0.831 . . . . 0.0 108.957 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 m -84.32 -13.65 51.83 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 114.9 -1.045 . . . . 0.0 112.049 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.488 ' HD2' ' OE1' ' A' ' 42' ' ' GLU . 54.6 mtpt -116.08 126.46 53.78 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 121.885 -0.509 . . . . 0.0 111.252 -173.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.45 -41.01 48.93 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.086 -0.507 . . . . 0.0 112.063 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -104.86 159.56 15.7 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.031 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -77.29 136.96 38.53 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 121.341 0.591 . . . . 0.0 111.982 -177.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.407 ' HB3' ' CE1' ' A' ' 11' ' ' TYR . 6.1 t70 -100.24 172.83 6.92 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.1 p -138.29 122.53 18.14 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -94.37 113.63 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 7' ' ' SER . 6.1 p -88.14 111.18 21.31 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.301 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.9 p90 -128.17 154.8 45.39 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -96.23 101.58 13.25 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.681 0.753 . . . . 0.0 109.675 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 157.49 -174.32 34.94 Favored Glycine 0 C--N 1.287 -2.162 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.64 -42.53 7.21 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.19 150.74 47.05 Favored 'General case' 0 CA--C 1.484 -1.596 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.75 179.788 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -120.65 129.39 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.4 0 CA-C-N 115.025 -0.988 . . . . 0.0 111.299 -177.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.8 m -56.83 141.62 43.91 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.609 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 64' ' ' ASP . 57.7 tp -56.12 -41.87 75.97 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -176.164 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.561 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 43.4 t -58.34 -45.93 87.22 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.512 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 2.9 m-20 -66.49 -44.52 82.38 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.534 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -59.12 -46.35 88.57 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 124.302 1.041 . . . . 0.0 110.016 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.3 mtmt -64.18 -42.27 96.75 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.655 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.47 -38.63 87.94 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 12.6 mm100 -62.11 -47.97 82.26 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.317 0.579 . . . . 0.0 109.56 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.8 mt -68.72 -42.78 83.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.325 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.3 mtt -61.39 -40.82 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.22 0.208 . . . . 0.0 111.065 -178.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.25 -35.78 60.24 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.544 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.48 ' HD2' ' OH ' ' A' ' 11' ' ' TYR . 31.5 ttm180 -73.12 -44.55 60.07 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.833 0.349 . . . . 0.0 111.864 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.488 ' OE1' ' HD2' ' A' ' 16' ' ' LYS . 58.6 mm-40 -91.56 9.05 33.71 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.601 -176.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . 0.34 0.0 OUTLIER 45.55 66.52 0.9 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.004 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -93.81 145.27 24.72 Favored 'General case' 0 CA--C 1.491 -1.306 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.596 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 8.0 ptpp? -88.87 101.56 14.17 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.186 173.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.26 -13.79 59.87 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.019 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.21 8.56 23.45 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.62 0.724 . . . . 0.0 109.985 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.484 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 15.0 t70 -130.57 -45.19 1.08 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.563 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.564 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 13.3 p -132.72 167.86 19.37 Favored 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.236 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -123.01 170.99 9.59 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 13.9 tp -118.25 127.17 53.48 Favored 'General case' 0 C--N 1.265 -3.103 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.551 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.6 tp60 -116.31 121.1 40.99 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.408 HD11 ' HG ' ' A' ' 51' ' ' LEU . 34.5 mm -106.73 135.57 44.7 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.7 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -173.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.8 m -122.72 148.02 45.8 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.4 t-20 -75.16 140.79 43.59 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.27 37.37 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.969 0.414 . . . . 0.0 111.278 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -95.65 -47.3 6.27 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.855 -176.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -90.79 -21.45 21.51 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.164 0.507 . . . . 0.0 109.778 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.9 mmmt 66.74 26.7 9.46 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.475 1.11 . . . . 0.0 109.914 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -91.86 136.18 33.35 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -79.86 147.56 31.69 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.801 0.81 . . . . 0.0 111.382 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -103.9 95.88 6.31 Favored 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.6 p -80.44 -47.38 14.44 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 114.942 -1.026 . . . . 0.0 113.541 -172.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.431 ' O ' HD23 ' A' ' 31' ' ' LEU . 3.1 t70 -94.65 145.94 24.49 Favored 'General case' 0 CA--C 1.487 -1.455 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.397 -175.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.444 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 8.8 p-10 -69.72 -4.35 19.35 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -88.96 -7.11 56.64 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.971 175.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.49 150.41 48.9 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.78 138.13 52.89 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.598 -0.689 . . . . 0.0 111.609 -174.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -115.3 115.13 42.75 Favored Pre-proline 0 C--N 1.319 -0.732 0 C-N-CA 120.059 -0.657 . . . . 0.0 110.415 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 94.9 Cg_endo -80.48 153.89 20.93 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 C-N-CA 123.154 2.569 . . . . 0.0 113.19 176.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.572 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.4 pttt -59.24 -25.01 63.67 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.68 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.57 -5.56 48.21 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -116.13 133.88 55.54 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.408 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.8 m -91.48 137.0 32.71 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.4 m -128.0 154.14 38.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 CA-C-O 121.481 0.658 . . . . 0.0 111.87 -177.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.92 133.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.438 ' CG1' HD11 ' A' ' 51' ' ' LEU . 48.2 t -106.27 109.96 29.78 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-O 121.275 0.56 . . . . 0.0 110.326 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -108.57 132.95 53.35 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.564 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 34.7 ttp85 -95.68 129.77 42.78 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -126.75 156.43 73.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 CA--C 1.54 0.783 0 C-N-CA 122.158 1.905 . . . . 0.0 111.978 178.939 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.562 ' O ' ' HA ' ' A' ' 23' ' ' THR . 30.4 m . . . . . 0 N--CA 1.411 -2.403 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.4 p -139.73 135.6 33.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.517 -177.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 21' ' ' THR . 78.9 t -106.9 125.12 62.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -76.91 108.94 10.31 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 44.5 p90 -127.22 135.63 50.91 Favored 'General case' 0 C--N 1.28 -2.418 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -115.8 136.08 53.4 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.05 160.84 16.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.448 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 16.1 m -58.32 -30.32 66.6 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.53 0.681 . . . . 0.0 110.058 174.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.1 m -86.04 1.61 49.64 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.607 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 138.43 54.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.015 0.912 . . . . 0.0 111.878 177.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -85.96 -27.1 25.12 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -110.2 172.05 7.09 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.611 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -92.11 139.59 30.48 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.224 0.535 . . . . 0.0 112.038 -176.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.13 175.37 5.5 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 173.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.9 p -137.42 131.3 31.78 Favored 'General case' 0 CA--C 1.48 -1.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 7.9 p -109.63 125.32 66.79 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 7' ' ' SER . 4.2 p -90.95 140.99 29.31 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.691 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.504 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.3 p90 -150.57 174.14 13.31 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -107.02 140.81 39.23 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.54 -175.02 18.55 Favored Glycine 0 C--N 1.298 -1.565 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 tt -90.06 -40.68 12.14 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.548 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -133.45 155.26 49.86 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.969 -1.014 . . . . 0.0 112.15 -178.273 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.3 tt -121.62 126.6 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.522 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.431 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 13.2 m -60.31 146.88 42.43 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.505 177.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 62' ' ' TYR . 47.5 tp -58.91 -38.12 78.18 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 123.751 0.821 . . . . 0.0 111.399 -177.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.696 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.8 t -55.81 -46.9 77.94 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 175.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 22.2 m-20 -68.61 -41.91 78.87 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.352 -176.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.16 -46.67 70.12 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.035 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.6 mtmt -64.41 -42.86 95.82 Favored 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 121.307 -0.157 . . . . 0.0 111.365 -178.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.44 -36.82 81.45 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.418 0.449 . . . . 0.0 111.037 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 11.8 mm-40 -71.18 -44.37 65.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.334 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.5 mt -66.87 -40.42 85.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.508 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 59.9 mtt -60.36 -40.01 89.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.523 0.201 . . . . 0.0 110.511 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.8 -39.55 54.86 Favored Glycine 0 N--CA 1.438 -1.231 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.941 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -68.76 -49.55 57.78 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -82.37 -14.15 55.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.018 -173.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.7 mmtm 75.37 65.63 0.07 Allowed 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 125.85 1.66 . . . . 0.0 110.528 -178.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.75 152.64 19.46 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.696 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -104.82 102.13 11.7 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.907 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.37 -7.72 51.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.442 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -9.14 43.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.082 0.467 . . . . 0.0 110.545 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -112.1 -42.53 3.73 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.105 -178.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.8 m -129.86 171.67 12.48 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.03 -176.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.45 170.56 11.28 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.446 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.0 tp -120.9 115.78 23.89 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -173.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.514 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.6 tt0 -114.46 112.89 23.72 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.333 0.587 . . . . 0.0 110.277 -175.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.446 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.8 mp -99.01 135.27 34.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.793 -175.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -124.39 134.92 52.98 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 123.091 0.556 . . . . 0.0 109.513 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.516 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.2 t-20 -61.41 135.34 57.65 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.422 0.289 . . . . 0.0 110.277 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.41 -25.81 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.975 0.417 . . . . 0.0 111.442 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -93.34 -52.38 4.55 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.917 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.1 p -95.11 -15.84 23.07 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 62.47 26.61 15.84 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.799 0.809 . . . . 0.0 112.13 -174.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -73.17 116.66 13.96 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.29 126.65 34.97 Favored 'General case' 0 N--CA 1.42 -1.968 0 CA-C-O 121.397 0.618 . . . . 0.0 110.592 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.427 ' HB3' HD22 ' A' ' 31' ' ' LEU . 61.5 m-85 -99.3 104.18 16.06 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-N 114.698 -1.137 . . . . 0.0 108.252 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.2 p -113.52 -2.37 13.89 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.745 0.783 . . . . 0.0 110.34 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -106.08 131.93 52.77 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -65.58 -12.6 54.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-O 121.311 0.576 . . . . 0.0 111.404 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -91.6 2.13 56.67 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.789 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.61 147.79 47.23 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 173.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.548 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.99 138.48 52.79 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.265 0.484 . . . . 0.0 110.979 -176.315 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.17 113.89 35.24 Favored Pre-proline 0 C--N 1.314 -0.965 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.218 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.473 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 69.2 Cg_endo -76.89 152.74 32.46 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.086 2.524 . . . . 0.0 113.379 176.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.9 pttt -59.29 -23.74 62.68 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -78.76 -17.18 56.21 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.792 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.9 m -100.03 139.87 35.07 Favored 'General case' 0 C--N 1.308 -1.201 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.358 -175.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -99.38 136.58 39.11 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.2 m -130.99 155.84 42.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 120.952 0.406 . . . . 0.0 110.66 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.18 130.82 55.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 53' ' ' ILE . 27.0 t -105.78 113.23 42.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.318 -175.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 37.6 ttm180 -106.31 143.6 34.2 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.957 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -105.28 117.07 33.07 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.514 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -114.5 154.23 46.58 Favored Pre-proline 0 C--N 1.301 -1.535 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.406 -175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 C--N 1.325 -0.692 0 C-N-CA 122.621 2.214 . . . . 0.0 111.367 178.228 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 73.4 m . . . . . 0 N--CA 1.406 -2.637 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 34.4 m -133.1 134.86 44.83 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.069 -172.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.501 ' O ' ' HA ' ' A' ' 21' ' ' THR . 92.2 t -106.54 134.46 48.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.435 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 41.9 m-70 -84.22 123.06 29.71 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 123.775 0.672 . . . . 0.0 109.324 177.075 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.606 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 53.3 p90 -136.64 142.27 43.23 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.072 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.44 ' HE3' HD12 ' A' ' 76' ' ' ILE . 21.7 pttp -123.64 116.23 22.76 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 119.801 -0.759 . . . . 0.0 110.232 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.652 ' HA ' HG13 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -68.77 165.61 19.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.435 -1.257 . . . . 0.0 111.275 178.814 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.4 m -56.61 -37.1 70.2 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.967 176.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.3 t -106.84 19.78 19.98 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.056 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -99.64 138.4 36.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.69 -31.72 16.48 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.647 0.737 . . . . 0.0 109.708 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -129.94 177.14 7.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -83.34 146.83 28.28 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.062 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.4 t70 -115.2 178.66 4.21 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -136.57 121.74 19.11 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 118.734 0.697 . . . . 0.0 110.677 -172.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.1 p -95.87 134.68 32.51 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.408 HG22 ' SG ' ' A' ' 8' ' ' CYS . 5.3 p -102.66 126.51 49.78 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.146 0.498 . . . . 0.0 111.494 -175.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' A' ' 7' ' ' SER . 29.3 p90 -141.29 172.27 12.91 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -106.83 137.5 44.75 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.0 -167.05 12.36 Favored Glycine 0 N--CA 1.429 -1.82 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.401 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.2 tm? -98.03 -31.63 12.05 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.631 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.16 147.67 33.99 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -112.16 123.95 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.297 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.9 m -63.97 143.32 57.95 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.953 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 46.8 tp -54.84 -41.05 70.27 Favored 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 124.684 1.194 . . . . 0.0 112.533 -175.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.639 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 32.2 t -53.18 -45.9 68.74 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 123.219 0.325 . . . . 0.0 110.339 176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.7 -39.8 61.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.523 0.678 . . . . 0.0 110.02 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 3.0 tm? -58.77 -47.21 85.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.287 -177.4 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.3 mtmt -70.68 -44.76 66.36 Favored 'General case' 0 C--O 1.203 -1.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.218 -178.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.0 mptp? -61.29 -37.71 84.16 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -175.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -64.64 -45.19 87.84 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.459 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.5 mt -73.95 -41.48 53.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.029 -176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 88.8 mtp -62.25 -37.64 86.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.708 0.289 . . . . 0.0 110.576 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.46 -42.4 41.31 Favored Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.781 176.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -64.73 -47.65 77.48 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -89.09 11.16 19.24 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.488 -175.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? 55.06 62.09 2.66 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 123.94 0.896 . . . . 0.0 111.169 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -91.61 145.88 24.24 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.567 177.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.621 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -95.13 101.77 13.54 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.58 -8.55 55.78 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.964 -175.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -90.18 -1.73 57.97 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.932 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.619 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 16.6 t70 -129.08 -37.12 1.71 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.453 0.644 . . . . 0.0 110.474 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -128.78 166.12 19.62 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-O 121.814 0.816 . . . . 0.0 112.424 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.47 169.32 12.52 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 126.02 1.728 . . . . 0.0 106.687 176.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.5 tp -117.42 111.25 19.06 Favored 'General case' 0 N--CA 1.404 -2.749 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HB2' HG12 ' A' ' 80' ' ' ILE . 62.1 tt0 -109.34 111.23 22.67 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.593 0.711 . . . . 0.0 109.853 -178.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' HG23 ' A' ' 77' ' ' VAL . 18.7 mm -92.95 136.18 25.68 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -123.37 143.19 50.27 Favored 'General case' 0 C--N 1.275 -2.654 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.433 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.0 t-20 -68.58 136.22 52.72 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 122.039 -0.413 . . . . 0.0 110.559 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -28.18 64.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -91.21 -58.18 2.54 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 121.186 0.517 . . . . 0.0 111.192 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 p -91.68 -17.44 25.47 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.195 -169.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.94 23.41 12.59 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.621 0.724 . . . . 0.0 112.549 -173.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.03 115.95 7.31 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -87.4 128.15 35.21 Favored 'General case' 0 N--CA 1.413 -2.293 0 CA-C-O 121.874 0.845 . . . . 0.0 110.174 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.2 93.53 8.73 Favored 'General case' 0 C--N 1.267 -2.995 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.062 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.8 p -98.36 -26.83 14.35 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.521 -1.218 . . . . 0.0 111.032 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -90.11 135.17 33.82 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 5.3 m-20 -68.81 -13.15 62.22 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.895 0.379 . . . . 0.0 111.801 -176.287 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -83.59 -9.19 59.08 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.155 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.12 136.25 57.67 Favored 'General case' 0 C--O 1.2 -1.513 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.631 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -117.82 137.65 52.61 Favored 'General case' 0 C--N 1.281 -2.391 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.221 -176.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -117.04 118.79 35.74 Favored Pre-proline 0 C--N 1.297 -1.693 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.729 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.3 Cg_endo -78.68 157.94 28.23 Favored 'Trans proline' 0 C--N 1.324 -0.718 0 C-N-CA 123.218 2.612 . . . . 0.0 113.404 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 49.6 pttt -70.19 -5.48 27.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.9 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -87.83 -4.27 58.88 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.759 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -122.43 157.94 30.82 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-O 120.973 0.416 . . . . 0.0 111.247 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m -118.86 137.76 53.21 Favored 'General case' 0 N--CA 1.422 -1.837 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 12.5 m -130.48 163.85 35.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.48 0.657 . . . . 0.0 111.697 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 ' HE3' ' A' ' 12' ' ' LYS . 13.9 mm -109.47 132.28 58.05 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.652 HG13 ' HA ' ' A' ' 13' ' ' PHE . 1.7 p -112.78 106.55 20.99 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 122.173 0.987 . . . . 0.0 111.207 -177.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -103.26 131.79 50.03 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.843 -174.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -90.51 117.57 29.3 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.505 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -116.6 151.56 47.26 Favored Pre-proline 0 C--N 1.308 -1.219 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -177.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo . . . . . 0 CA--C 1.549 1.248 0 C-N-CA 122.399 2.066 . . . . 0.0 112.362 178.995 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 71' ' ' LYS . 67.4 m . . . . . 0 N--CA 1.406 -2.657 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.1 p -144.73 135.14 24.37 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.084 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 71' ' ' LYS . 69.0 t -106.19 125.63 61.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -81.05 117.31 21.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 124.185 0.928 . . . . 0.0 108.874 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.621 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -133.26 140.55 47.55 Favored 'General case' 0 C--N 1.29 -1.995 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -124.26 140.92 52.5 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.62 165.68 18.8 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 m -56.55 -37.36 70.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.812 0.815 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.92 -3.87 55.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.573 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -110.52 143.34 41.01 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.9 tp -94.99 -37.73 11.0 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.573 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -99.97 158.02 16.12 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.391 -0.523 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.65 137.14 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 116.07 -0.514 . . . . 0.0 112.039 -176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -95.31 174.7 6.91 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 171.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -138.34 133.91 33.58 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -175.735 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.626 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.3 m -94.9 114.92 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 171.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -90.21 114.41 26.39 Favored 'General case' 0 N--CA 1.41 -2.46 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.152 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.434 ' CE1' HG23 ' A' ' 9' ' ' VAL . 5.5 p90 -135.83 165.39 25.73 Favored 'General case' 0 C--N 1.282 -2.327 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -177.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 6.01 32.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -174.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.48 -178.52 45.37 Favored Glycine 0 C--N 1.285 -2.25 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.577 177.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -89.78 -39.84 12.86 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.81 153.27 44.4 Favored 'General case' 0 CA--C 1.488 -1.437 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.045 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.0 tt -123.47 129.41 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.242 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.711 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -63.11 145.0 56.41 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.234 178.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.1 tp -54.99 -44.43 74.48 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.502 1.121 . . . . 0.0 112.981 -176.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.547 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.8 t -57.0 -45.58 82.9 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.148 0.499 . . . . 0.0 109.755 178.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 9.4 m-20 -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.146 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.77 95.96 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.04 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' HD23 ' A' ' 51' ' ' LEU . 54.7 mtmt -63.11 -41.55 99.38 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.252 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.61 -37.46 84.0 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.593 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.531 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -66.03 -50.23 64.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.083 0.468 . . . . 0.0 109.796 178.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.32 -43.36 91.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.632 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' HD22 ' A' ' 44' ' ' LEU . 71.7 mtm -66.02 -34.99 79.35 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.222 -0.191 . . . . 0.0 111.264 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.2 -39.98 51.12 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.496 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.416 HH22 ' HA ' ' A' ' 22' ' ' VAL . 23.7 ttm180 -67.47 -48.03 68.36 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 123.375 0.67 . . . . 0.0 112.151 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -91.49 2.11 56.66 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.316 -174.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.39 65.45 1.17 Allowed 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 124.444 1.098 . . . . 0.0 111.28 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 ' HG2' ' A' ' 39' ' ' MET . 10.8 mp -95.09 173.55 7.52 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.21 177.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HG3' ' SG ' ' A' ' 49' ' ' CYS . 16.8 ptpt -105.95 101.33 10.83 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.334 178.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.92 -13.29 59.89 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.384 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.58 4.68 45.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.997 0.427 . . . . 0.0 111.211 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -124.72 -40.53 2.19 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.391 0.615 . . . . 0.0 109.464 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.462 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 24.4 p -134.03 164.35 27.52 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.963 -178.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -116.12 170.36 8.56 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.508 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.8 tp -115.43 123.71 49.3 Favored 'General case' 0 C--N 1.267 -3.019 0 CA-C-O 121.456 0.646 . . . . 0.0 109.283 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.552 ' HB2' HG12 ' A' ' 80' ' ' ILE . 5.1 tp-100 -103.4 123.94 47.78 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -177.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.412 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.1 mp -116.79 127.83 74.32 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.3 m -115.73 146.89 41.5 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.616 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -77.0 138.14 39.42 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.16 -21.42 46.48 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.683 0.754 . . . . 0.0 110.987 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -98.53 -56.23 2.52 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.927 -175.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.9 p -85.93 -19.65 30.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.553 0.692 . . . . 0.0 109.672 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.1 mmtp 63.45 21.07 12.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.914 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -77.89 129.51 35.46 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -93.62 127.82 39.49 Favored 'General case' 0 N--CA 1.416 -2.13 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -94.65 96.0 9.13 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -92.54 -21.14 20.28 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.025 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.461 ' HB3' ' OD1' ' A' ' 66' ' ' ASN . 12.8 m-20 -97.92 133.35 42.52 Favored 'General case' 0 CA--C 1.492 -1.275 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.475 ' HA ' HD23 ' A' ' 31' ' ' LEU . 3.1 p30 -73.39 -4.07 31.22 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -175.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.461 ' OD1' ' HB3' ' A' ' 64' ' ' ASP . 1.9 p-10 -85.35 -10.05 56.83 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.043 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.0 146.11 48.28 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.494 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.45 137.42 52.52 Favored 'General case' 0 C--N 1.289 -2.041 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.328 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.65 114.44 39.92 Favored Pre-proline 0 N--CA 1.435 -1.193 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.065 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.0 Cg_endo -78.89 156.67 27.16 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.166 2.577 . . . . 0.0 112.389 176.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.484 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.62 -7.48 33.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.925 0.869 . . . . 0.0 111.811 178.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -83.43 -11.88 57.04 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.39 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.9 m -112.58 152.25 29.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 120.888 0.375 . . . . 0.0 111.366 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.9 m -109.9 132.42 54.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 173.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.621 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.8 m -127.39 160.52 36.37 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -175.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.1 mm -112.29 132.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 HG13 ' A' ' 53' ' ' ILE . 25.0 t -109.24 129.71 63.51 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 CA-C-O 121.086 0.47 . . . . 0.0 110.789 -175.184 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 52' ' ' GLN . 29.4 ttm180 -126.61 152.26 46.88 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 125.225 1.41 . . . . 0.0 107.744 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.406 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 18.3 ttp180 -110.24 127.74 55.14 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.552 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.9 pp -132.59 161.58 62.43 Favored Pre-proline 0 C--O 1.21 -0.995 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.693 -175.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 33.2 Cg_endo . . . . . 0 N--CA 1.48 0.728 0 C-N-CA 122.362 2.041 . . . . 0.0 112.12 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 46.0 m . . . . . 0 N--CA 1.424 -1.739 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.642 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.6 p -147.78 142.41 26.6 Favored 'General case' 0 N--CA 1.422 -1.826 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.608 -175.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.8 t -107.18 136.55 41.87 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 178.182 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -83.32 109.54 17.36 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HG13 ' A' ' 22' ' ' VAL . 30.9 p90 -124.81 140.2 53.14 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 19' ' ' TYR . 63.8 pttt -125.68 123.2 38.38 Favored 'General case' 0 C--N 1.293 -1.872 0 C-N-CA 118.443 -1.303 . . . . 0.0 110.956 174.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 1.4 t80 -84.34 172.44 11.79 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.276 -176.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -64.13 -27.0 68.78 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.563 0.697 . . . . 0.0 109.232 170.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.7 m -82.57 -20.32 36.77 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.338 178.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.56 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 0.9 OUTLIER -111.65 101.46 9.85 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.672 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.76 -33.27 75.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.592 0.71 . . . . 0.0 110.646 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -114.36 169.19 9.22 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.633 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.445 ' HA ' ' HB3' ' A' ' 12' ' ' LYS . 98.5 m-85 -70.5 147.64 49.15 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -121.88 177.35 5.33 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 104.615 -2.365 . . . . 0.0 104.615 176.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.8 p -135.64 127.19 28.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -95.97 114.95 33.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.574 171.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 7' ' ' SER . 2.2 p -85.47 124.86 32.54 Favored 'General case' 0 N--CA 1.418 -2.045 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 7' ' ' SER . 38.5 p90 -142.28 176.68 8.8 Favored 'General case' 0 N--CA 1.434 -1.266 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -105.35 136.66 44.48 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.687 0.279 . . . . 0.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.95 -147.74 18.5 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.533 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.33 -39.8 4.32 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.75 157.86 45.3 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.432 -179.069 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -128.35 129.43 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.092 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.336 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.8 m -61.66 148.08 43.76 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.054 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.45 HD23 ' O ' ' A' ' 64' ' ' ASP . 51.7 tp -57.48 -41.53 80.87 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 124.186 0.994 . . . . 0.0 112.547 -176.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.678 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 48.0 t -55.61 -46.47 77.33 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 4.5 m-20 -69.88 -42.57 73.27 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.28 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.416 ' HG ' HD13 ' A' ' 69' ' ' ILE . 2.5 tm? -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 124.03 0.932 . . . . 0.0 110.361 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.9 mtmt -67.19 -38.3 85.15 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.566 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.678 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 1.6 mptm? -61.39 -36.57 80.64 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -64.4 -50.09 69.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 109.491 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.2 mt -73.01 -41.4 59.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.471 -174.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.4 mtt -59.94 -44.43 94.37 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 110.455 -0.202 . . . . 0.0 110.455 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.78 -33.7 71.29 Favored Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.727 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -71.92 -46.44 57.61 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -91.5 -1.5 57.51 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 120.858 0.361 . . . . 0.0 111.943 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm 66.93 66.96 0.42 Allowed 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 125.08 1.352 . . . . 0.0 110.363 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.81 170.01 9.61 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 17.9 ptpt -112.46 101.72 9.87 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.099 175.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.15 -6.6 59.54 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.364 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.94 -3.97 53.56 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.389 0.614 . . . . 0.0 110.171 177.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.417 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 31.8 t70 -128.68 -30.3 2.31 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.58 0.705 . . . . 0.0 111.486 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.6 m -132.06 157.24 44.67 Favored 'General case' 0 N--CA 1.414 -2.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.38 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.481 ' HB3' HD11 ' A' ' 80' ' ' ILE . 37.5 t0 -120.01 162.19 19.66 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 53' ' ' ILE . 21.3 tp -108.92 108.13 18.77 Favored 'General case' 0 C--N 1.257 -3.429 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 -177.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -97.53 116.66 30.17 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-O 121.693 0.759 . . . . 0.0 109.249 -174.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.579 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.2 mm -105.26 130.52 56.36 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.757 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 m -125.02 141.59 52.03 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.59 128.9 38.51 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 122.594 0.357 . . . . 0.0 110.955 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.87 -29.51 65.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.24 0.543 . . . . 0.0 110.341 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -87.78 -58.11 2.69 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.862 -177.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.4 p -90.64 -14.28 32.66 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -171.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.17 21.69 12.98 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 123.344 0.658 . . . . 0.0 112.769 -172.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -74.74 121.87 22.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -92.31 119.54 31.99 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.571 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 87.7 m-85 -55.72 -65.29 0.62 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 123.645 0.778 . . . . 0.0 112.416 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.8 p 74.41 -36.8 0.34 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 127.802 2.441 . . . . 0.0 114.631 171.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' HD23 ' A' ' 31' ' ' LEU . 4.6 t70 -95.49 132.88 40.12 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -174.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 9.5 m-20 -65.27 -14.18 60.14 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.24 0.543 . . . . 0.0 111.703 -175.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -91.97 -1.97 56.99 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.48 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -72.49 145.1 47.76 Favored 'General case' 0 C--O 1.194 -1.836 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.53 138.32 51.98 Favored 'General case' 0 C--N 1.288 -2.104 0 CA-C-N 118.825 0.739 . . . . 0.0 111.399 -173.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.494 HG13 ' CZ ' ' A' ' 62' ' ' TYR . 3.2 mp -114.06 115.51 45.5 Favored Pre-proline 0 C--N 1.312 -1.042 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.506 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 92.3 Cg_endo -81.11 159.62 20.57 Favored 'Trans proline' 0 C--N 1.324 -0.761 0 C-N-CA 123.116 2.544 . . . . 0.0 113.479 175.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -73.35 4.83 4.18 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.966 176.049 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -87.54 -19.07 28.39 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.0 m -109.63 162.31 14.55 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.625 0.726 . . . . 0.0 112.765 -173.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.4 m -121.51 130.56 53.62 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.6 m -129.01 158.79 41.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.4 mm -99.69 129.17 50.68 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.562 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 59.9 t -109.74 111.48 36.33 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 CA-C-O 121.556 0.693 . . . . 0.0 109.46 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.0 ttp-105 -121.23 136.34 54.99 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.824 -174.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -93.08 128.35 38.95 Favored 'General case' 0 C--N 1.292 -1.899 0 O-C-N 121.954 -0.466 . . . . 0.0 110.216 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.481 HD11 ' HB3' ' A' ' 50' ' ' ASP . 2.5 pp -125.72 152.37 72.16 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 C--N 1.326 -0.649 0 C-N-CA 122.153 1.902 . . . . 0.0 111.117 177.003 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.522 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 49.5 m . . . . . 0 N--CA 1.408 -2.545 0 CA-C-O 120.671 0.272 . . . . 0.0 110.411 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.3 p -145.01 141.77 29.21 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.007 -178.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.515 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.2 t -107.02 129.9 59.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -80.61 110.85 16.49 Favored 'General case' 0 CA--C 1.491 -1.293 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 174.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.607 ' OH ' ' HG2' ' A' ' 41' ' ' ARG . 37.6 p90 -131.9 146.37 52.07 Favored 'General case' 0 C--N 1.28 -2.449 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -130.55 141.98 50.47 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.501 ' HZ ' HD21 ' A' ' 44' ' ' LEU . 1.1 t80 -89.81 169.35 11.34 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -177.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.2 m -56.93 -37.01 70.89 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.999 0.428 . . . . 0.0 111.297 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.7 m -90.99 4.02 53.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 25.9 mtpp -117.62 125.93 51.62 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.0 tt -83.26 -42.0 17.7 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.2 157.81 20.53 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -88.44 146.78 25.03 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 120.964 0.411 . . . . 0.0 110.698 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -112.06 174.76 5.73 Favored 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 p -139.37 115.71 10.5 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.144 0.497 . . . . 0.0 111.238 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.8 p -95.86 120.85 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.082 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 177.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.0 p -87.95 140.24 29.7 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.515 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.8 p90 -151.94 170.89 18.75 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -178.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -102.45 138.29 39.57 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.184 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.09 -173.91 17.06 Favored Glycine 0 N--CA 1.433 -1.509 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -88.66 -31.32 18.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.563 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -147.69 157.5 43.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -175.417 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 tt -121.73 128.5 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.247 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 16.3 m -63.79 147.09 52.65 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.223 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 64' ' ' ASP . 48.2 tp -57.81 -42.77 84.97 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 124.019 0.927 . . . . 0.0 112.419 -176.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -54.25 -45.17 72.33 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 19.2 m-20 -68.23 -49.69 59.01 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.463 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.2 -45.47 91.0 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.822 -1.081 . . . . 0.0 112.746 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' HD23 ' A' ' 51' ' ' LEU . 51.9 mtmt -63.05 -41.49 99.49 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.785 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.613 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.3 mptp? -61.58 -38.48 87.68 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 120.664 0.268 . . . . 0.0 110.373 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 15.4 mm100 -68.15 -50.15 56.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.69 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.8 mt -70.47 -39.07 75.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.7 mtm -64.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.967 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.36 -35.53 56.29 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.449 175.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 25.3 tpt180 -61.06 -51.17 70.31 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.197 0.999 . . . . 0.0 111.9 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.38 -1.12 54.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.86 0.362 . . . . 0.0 111.856 -176.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm 66.22 68.5 0.44 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 125.092 1.357 . . . . 0.0 110.48 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 ' HZ ' ' A' ' 13' ' ' PHE . 9.3 mp -95.52 158.22 15.55 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.793 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' HD3' ' HB2' ' A' ' 48' ' ' ASP . 8.1 ptpp? -85.1 101.04 12.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 170.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.72 -7.49 59.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -169.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.22 -12.85 17.7 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.705 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.473 ' HB2' ' HD3' ' A' ' 45' ' ' LYS . 4.0 m-20 -105.93 -16.5 14.62 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -175.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -148.03 170.29 18.07 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -120.94 164.9 16.0 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.475 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.5 tp -116.27 113.62 23.24 Favored 'General case' 0 N--CA 1.405 -2.724 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.539 ' HB2' HG12 ' A' ' 80' ' ' ILE . 33.8 tt0 -111.13 112.0 23.49 Favored 'General case' 0 C--N 1.281 -2.402 0 CA-C-O 121.781 0.801 . . . . 0.0 109.23 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.434 ' CD1' HG13 ' A' ' 77' ' ' VAL . 29.0 mm -90.53 135.77 25.68 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.48 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.663 -172.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 14.9 m -117.88 145.33 44.7 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.4 t-20 -74.73 141.98 44.42 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -84.97 -27.52 26.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.715 0.769 . . . . 0.0 110.62 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -85.03 -48.68 8.99 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.559 -175.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -98.1 -20.27 17.45 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.252 0.548 . . . . 0.0 110.076 -176.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 60.79 36.96 19.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.675 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -101.27 132.57 46.72 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 1.1 mp0 -81.69 148.11 29.16 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-O 121.878 0.847 . . . . 0.0 112.36 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -108.14 101.11 10.37 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 173.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.8 p -97.97 -27.26 14.33 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.286 0.565 . . . . 0.0 112.013 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' HD23 ' A' ' 31' ' ' LEU . 29.8 m-20 -91.01 128.46 36.84 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -177.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -66.96 -6.26 16.05 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -95.32 1.77 54.52 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.749 178.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.53 152.72 43.67 Favored 'General case' 0 C--O 1.207 -1.182 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 173.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.563 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.83 138.29 52.82 Favored 'General case' 0 C--N 1.289 -2.031 0 O-C-N 121.77 -0.581 . . . . 0.0 111.473 -178.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.49 117.16 38.55 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.223 175.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.476 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 74.0 Cg_endo -80.21 161.17 23.21 Favored 'Trans proline' 0 C--N 1.328 -0.523 0 C-N-CA 123.522 2.815 . . . . 0.0 114.064 177.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.522 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 47.4 pttt -67.62 -16.37 64.13 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.222 176.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -70.87 -25.64 62.89 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.796 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.8 m -98.32 159.68 14.79 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-O 121.639 0.733 . . . . 0.0 112.17 -173.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.9 m -124.01 127.87 48.54 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 173.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 55' ' ' ASN . 21.9 m -125.38 155.0 34.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 CA-C-O 121.593 0.711 . . . . 0.0 112.8 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.4 mm -104.16 127.84 58.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.475 ' CG1' HD11 ' A' ' 51' ' ' LEU . 60.0 t -99.46 111.58 29.46 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.519 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.359 -175.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -110.55 130.93 55.45 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.889 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -89.75 127.55 35.97 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.539 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.85 150.11 55.04 Favored Pre-proline 0 C--N 1.305 -1.364 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.085 -178.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo . . . . . 0 N--CA 1.448 -1.165 0 C-N-CA 122.063 1.842 . . . . 0.0 112.196 178.838 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.1 m . . . . . 0 N--CA 1.414 -2.264 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.5 p -127.29 128.61 46.25 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.075 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 71' ' ' LYS . 41.2 t -106.93 131.05 57.88 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -86.64 112.7 21.86 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.1 p90 -126.2 133.23 51.59 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.867 -177.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -118.35 135.74 54.14 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.134 -1.026 . . . . 0.0 108.962 175.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.533 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 1.2 t80 -92.52 165.34 13.07 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -176.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -56.86 -31.95 65.32 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.45 0.643 . . . . 0.0 109.799 175.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.5 m -82.68 -8.73 59.58 Favored 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.959 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD2' ' H ' ' A' ' 13' ' ' PHE . 65.5 mttm -108.66 146.33 33.6 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 121.928 -0.483 . . . . 0.0 110.72 -177.021 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.4 tp -92.65 -46.19 7.71 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 171.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -97.24 155.87 16.67 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.778 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -75.8 135.96 40.25 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 121.305 0.574 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -94.74 177.85 5.78 Favored 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -137.48 128.11 26.85 Favored 'General case' 0 C--N 1.28 -2.44 0 CA-C-N 118.432 0.56 . . . . 0.0 111.462 -174.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.528 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -113.22 136.28 50.07 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.0 p -112.28 138.76 48.52 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 120.849 0.357 . . . . 0.0 111.517 -178.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.567 ' HE1' HG23 ' A' ' 9' ' ' VAL . 35.1 p90 -151.57 176.3 11.48 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.69 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -103.82 150.11 24.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 175.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.07 161.52 34.19 Favored Glycine 0 C--N 1.303 -1.296 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 tt -71.88 -32.79 67.79 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 118.074 0.937 . . . . 0.0 108.841 -177.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.518 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -138.5 159.8 41.16 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.369 -176.142 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.8 tt -128.66 128.15 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.593 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -56.83 142.27 41.53 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.893 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.2 tp -58.23 -34.77 70.8 Favored 'General case' 0 N--CA 1.419 -1.994 0 C-N-CA 124.738 1.215 . . . . 0.0 110.727 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.698 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 11.7 t -58.36 -46.49 86.2 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -74.42 -41.46 60.84 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.613 -176.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.5 tm? -59.0 -47.34 85.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.001 1.32 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.5 mtmt -67.05 -43.29 83.08 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 120.535 0.207 . . . . 0.0 111.021 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.698 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.92 -35.19 77.67 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.83 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.03 -49.95 72.62 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 120.881 0.372 . . . . 0.0 110.152 175.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.8 mt -69.17 -44.85 80.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.739 -175.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 73.8 mtm -66.05 -39.89 90.49 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.238 -178.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.24 -37.11 86.22 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.038 -1.077 . . . . 0.0 111.221 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -65.43 -49.03 70.69 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 123.065 0.546 . . . . 0.0 111.836 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 46.5 mt-10 -103.34 19.6 19.36 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.8 mmtt 62.16 34.11 16.44 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.676 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.8 mp -71.96 132.77 44.77 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.068 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 16.4 ptpt -71.86 101.4 2.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 122.144 0.973 . . . . 0.0 111.293 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.71 -7.91 57.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.896 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.83 -0.4 45.23 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.574 0.702 . . . . 0.0 110.349 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.465 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 9.3 t70 -113.05 -41.18 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.032 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -133.34 166.7 21.89 Favored 'General case' 0 N--CA 1.415 -2.225 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.459 -174.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -116.86 166.66 11.9 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.546 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 14.2 tp -112.79 125.45 54.36 Favored 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -111.52 109.04 18.77 Favored 'General case' 0 C--N 1.284 -2.277 0 O-C-N 121.777 -0.577 . . . . 0.0 109.709 -177.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.467 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.9 mp -99.69 125.65 53.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 CA-C-O 121.388 0.613 . . . . 0.0 110.084 -176.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.9 m -115.22 137.1 52.39 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.7 t-20 -67.15 138.24 56.89 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.76 -20.82 41.83 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.499 0.666 . . . . 0.0 111.263 -177.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -98.83 -47.33 5.33 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.384 -174.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 42.8 p -95.15 -22.59 17.76 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.4 0.619 . . . . 0.0 109.938 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 69.68 21.58 6.51 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 125.394 1.478 . . . . 0.0 111.538 -175.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.52 119.53 12.47 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.669 -1.151 . . . . 0.0 108.419 176.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -90.16 121.02 31.82 Favored 'General case' 0 N--CA 1.411 -2.386 0 CA-C-O 121.522 0.677 . . . . 0.0 110.889 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -93.21 100.77 13.08 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -100.64 -22.34 14.96 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.768 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' O ' HD23 ' A' ' 31' ' ' LEU . 7.2 t70 -99.94 137.87 37.79 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.625 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -60.03 -19.55 53.26 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -78.4 -8.73 58.8 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.9 152.16 45.1 Favored 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.518 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.4 138.6 52.98 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 118.604 0.638 . . . . 0.0 112.516 -176.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.21 115.23 38.28 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.57 173.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 47.3 Cg_endo -77.76 151.39 28.15 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.991 2.46 . . . . 0.0 113.016 174.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.588 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -67.18 -10.87 54.79 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.973 0.892 . . . . 0.0 113.294 -177.714 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -87.18 -4.77 59.13 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.875 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.6 m -109.73 143.15 39.92 Favored 'General case' 0 N--CA 1.426 -1.648 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.1 m -103.58 129.08 50.75 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.5 m -124.45 159.59 30.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -174.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -101.39 134.49 41.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.1 t -114.58 114.44 46.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 CA-C-O 121.053 0.454 . . . . 0.0 109.784 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -113.62 132.29 55.81 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.613 -177.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -85.96 121.88 29.22 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.587 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -123.25 147.99 53.67 Favored Pre-proline 0 C--O 1.206 -1.221 0 C-N-CA 120.551 -0.46 . . . . 0.0 109.916 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--N 1.31 -1.45 0 C-N-CA 121.989 1.793 . . . . 0.0 111.255 179.573 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.492 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 18.0 m . . . . . 0 N--CA 1.402 -2.851 0 CA-C-O 121.653 0.74 . . . . 0.0 111.113 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -138.69 129.04 25.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.091 -177.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 21' ' ' THR . 51.3 t -107.23 132.12 55.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.502 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 49.4 m-70 -80.8 108.83 14.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.58 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 32.8 p90 -124.37 137.48 54.46 Favored 'General case' 0 C--N 1.281 -2.373 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -120.32 133.29 55.48 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 174.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -88.88 153.71 20.83 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 -177.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.2 p -68.45 -12.45 61.21 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.383 0.611 . . . . 0.0 111.484 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.9 p -87.78 -9.72 53.11 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.307 0.575 . . . . 0.0 109.884 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -113.66 -176.96 3.02 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.3 tp -134.23 -20.69 1.88 Allowed 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.346 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -104.77 157.37 17.24 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.23 147.68 27.86 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.455 175.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 6.9 t70 -123.43 178.69 5.04 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 5.6 p -130.05 115.41 17.06 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 118.551 0.614 . . . . 0.0 110.916 -173.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -95.54 135.62 29.08 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.018 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 7' ' ' SER . 10.0 p -105.46 146.04 30.04 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -174.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.5 p90 -156.51 176.44 12.7 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -113.06 135.0 54.27 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 173.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.53 177.43 16.32 Favored Glycine 0 N--CA 1.425 -2.04 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -81.47 -32.41 32.54 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.64 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -148.99 160.08 43.64 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.973 -175.979 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.4 tt -126.24 128.01 71.22 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.008 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.8 m -61.94 147.93 45.28 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.35 0.66 . . . . 0.0 111.093 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 43.5 tp -54.67 -46.34 74.01 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.485 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -56.05 -45.31 79.26 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 120.969 0.414 . . . . 0.0 109.959 179.012 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.04 -41.23 82.39 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.611 0.719 . . . . 0.0 111.073 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.8 -46.8 87.95 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.555 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HA ' HD23 ' A' ' 51' ' ' LEU . 57.9 mtmt -66.11 -39.39 89.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.828 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.7 mptp? -61.63 -39.38 91.1 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.227 0.329 . . . . 0.0 111.488 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -66.62 -47.69 71.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.273 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.11 -47.39 78.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.4 mtm -64.72 -38.26 90.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.908 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.55 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.925 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -71.92 -50.14 31.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.079 0.466 . . . . 0.0 111.327 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.32 -9.75 58.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.486 -173.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm 71.71 62.29 0.15 Allowed 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 125.316 1.446 . . . . 0.0 110.564 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.03 158.36 15.59 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.044 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -106.83 104.41 14.09 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 122.171 0.986 . . . . 0.0 109.706 176.844 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.65 61.8 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.158 -176.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.49 58.09 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.188 0.518 . . . . 0.0 110.782 178.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.596 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 19.2 t70 -117.04 -39.61 3.21 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.727 0.775 . . . . 0.0 110.102 178.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.5 p -138.8 160.81 38.78 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.833 -174.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -115.31 167.39 10.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.0 tp -114.57 109.82 18.85 Favored 'General case' 0 N--CA 1.404 -2.747 0 CA-C-O 121.502 0.668 . . . . 0.0 109.62 -174.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.0 tt0 -94.15 120.78 34.88 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -176.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.468 HD11 ' HG ' ' A' ' 51' ' ' LEU . 25.8 mm -109.02 130.87 61.21 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.472 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -176.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.8 m -120.38 147.54 44.92 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.487 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.6 t-20 -78.33 138.67 38.68 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.07 37.77 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.444 0.64 . . . . 0.0 110.933 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -95.79 -51.89 4.31 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.594 -173.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -89.73 -18.27 26.68 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.524 0.678 . . . . 0.0 109.789 -176.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.6 mmmt 65.4 24.13 12.01 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.078 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -84.75 129.45 34.82 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -85.87 127.42 34.58 Favored 'General case' 0 N--CA 1.417 -2.086 0 CA-C-O 121.626 0.727 . . . . 0.0 109.716 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.14 93.91 8.25 Favored 'General case' 0 C--N 1.272 -2.765 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.074 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -88.36 -28.35 21.03 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.342 -1.299 . . . . 0.0 113.446 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -99.9 146.08 27.07 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.6 m-20 -73.34 -5.95 42.98 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -85.5 -11.76 53.42 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.888 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 31' ' ' LEU . . . -60.71 114.08 2.82 Favored 'General case' 0 C--O 1.203 -1.345 0 O-C-N 124.074 0.859 . . . . 0.0 111.298 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.64 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -91.6 138.65 31.4 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.443 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.73 115.6 43.78 Favored Pre-proline 0 C--N 1.301 -1.5 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.669 173.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.6 Cg_endo -79.57 158.5 25.31 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.449 2.766 . . . . 0.0 113.232 176.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 52.5 pttt -68.48 -4.33 14.6 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.617 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -86.74 -11.09 52.12 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.209 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.6 m -118.71 154.33 32.93 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 m -109.37 131.76 54.77 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.47 HG12 ' HA ' ' A' ' 55' ' ' ASN . 19.0 m -126.11 157.44 36.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-O 121.854 0.835 . . . . 0.0 112.882 -175.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mm -99.23 127.25 52.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.435 ' CG1' HD11 ' A' ' 51' ' ' LEU . 58.3 t -108.45 114.31 46.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.382 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -118.4 138.64 52.31 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.566 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -93.33 122.92 36.24 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.568 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -124.08 153.8 68.05 Favored Pre-proline 0 C--N 1.31 -1.149 0 O-C-N 122.195 -0.315 . . . . 0.0 110.596 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo . . . . . 0 C--N 1.323 -0.776 0 C-N-CA 121.828 1.685 . . . . 0.0 111.199 178.956 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.401 -2.901 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.606 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.1 p -133.39 134.6 43.9 Favored 'General case' 0 C--N 1.294 -1.829 0 C-N-CA 120.22 -0.592 . . . . 0.0 111.41 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.5 HG23 ' CE1' ' A' ' 24' ' ' PHE . 52.0 t -107.32 123.42 62.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.861 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -78.3 114.36 17.12 Favored 'General case' 0 N--CA 1.419 -2.001 0 O-C-N 124.152 0.907 . . . . 0.0 108.907 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.524 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 50.0 p90 -125.05 131.94 53.28 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -117.37 131.22 56.82 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 118.404 -1.318 . . . . 0.0 109.304 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.453 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -86.17 156.68 20.23 Favored 'General case' 0 C--N 1.273 -2.748 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -177.515 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.3 p -60.26 -27.79 67.53 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.243 0.544 . . . . 0.0 110.527 175.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.6 m -96.78 8.43 44.33 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.703 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HD3' ' CB ' ' A' ' 13' ' ' PHE . 5.9 mptp? -108.69 157.16 18.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.11 -34.24 13.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.197 0.522 . . . . 0.0 110.52 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -133.37 175.98 8.93 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -77.11 141.82 40.03 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.336 0.589 . . . . 0.0 111.38 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -108.33 177.31 4.83 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 p -136.79 136.47 38.88 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -175.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -98.72 122.27 50.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 167.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.0 p -93.86 123.54 37.28 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.5 ' CE1' HG23 ' A' ' 9' ' ' VAL . 47.0 p90 -140.94 177.36 8.1 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -178.025 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -120.27 118.59 30.84 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.461 0.573 . . . . 0.0 112.355 -175.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 134.69 -113.89 1.2 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.86 174.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -131.48 -45.23 0.99 Allowed 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.613 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -141.18 161.66 37.35 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -125.16 127.75 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.133 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.8 m -58.83 137.92 57.51 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.525 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.441 HD11 ' CG1' ' A' ' 53' ' ' ILE . 53.2 tp -54.79 -41.7 70.88 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 124.432 1.093 . . . . 0.0 112.672 -175.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 8.1 t -57.42 -45.42 84.64 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.2 t70 -66.41 -42.36 87.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -64.94 -46.87 79.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.883 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.564 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 41.3 mtmt -69.04 -37.89 78.84 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.813 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.7 mptt -61.84 -39.49 92.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.003 177.2 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 74.7 mt-30 -64.02 -50.88 66.71 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.018 177.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.79 -46.59 96.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.854 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG2' HD22 ' A' ' 44' ' ' LEU . 67.3 mtm -64.92 -38.34 90.63 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.879 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.86 -33.31 57.84 Favored Glycine 0 C--N 1.315 -0.636 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.156 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -72.96 -48.49 36.26 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 123.463 0.705 . . . . 0.0 112.013 -177.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -95.47 -0.45 52.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.166 0.508 . . . . 0.0 112.125 -173.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.419 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 44.5 mmtt 67.35 68.23 0.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.904 177.209 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD22 ' HG2' ' A' ' 39' ' ' MET . 11.1 mp -98.1 170.74 8.7 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.075 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -109.88 101.7 10.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.501 0.667 . . . . 0.0 110.106 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.15 -9.04 59.87 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 123.683 0.793 . . . . 0.0 111.271 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.3 -5.63 54.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -131.54 -29.82 1.72 Allowed 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.06 0.933 . . . . 0.0 110.814 -176.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.5 m -130.01 159.35 36.96 Favored 'General case' 0 N--CA 1.399 -3.004 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -176.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -118.36 169.56 9.64 Favored 'General case' 0 C--N 1.287 -2.119 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.564 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 24.0 tp -114.15 119.02 35.68 Favored 'General case' 0 C--N 1.248 -3.812 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.502 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.5 tt0 -113.22 117.2 31.21 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 -175.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.441 ' CG1' HD11 ' A' ' 31' ' ' LEU . 39.2 mm -99.91 135.55 35.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.695 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -176.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 m -123.65 145.36 49.01 Favored 'General case' 0 C--N 1.287 -2.145 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -71.17 139.29 50.14 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.766 -0.584 . . . . 0.0 109.915 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.22 56.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.921 0.391 . . . . 0.0 111.336 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -94.69 -48.29 6.13 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.69 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.2 p -95.31 -19.24 20.14 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.769 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 59.58 41.62 18.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -94.94 126.63 40.4 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -80.87 135.42 35.92 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-O 120.848 0.356 . . . . 0.0 110.238 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -94.0 100.45 12.58 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -83.2 -47.32 11.69 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.682 -1.145 . . . . 0.0 114.06 -170.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -90.97 147.48 23.07 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -78.11 -1.43 32.45 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.298 0.57 . . . . 0.0 112.306 -176.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -92.79 -2.43 55.96 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.943 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.55 148.64 51.39 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 174.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.613 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -118.91 138.76 52.54 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 118.237 0.471 . . . . 0.0 111.634 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.26 117.25 36.81 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.239 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.4 Cg_endo -78.34 154.43 28.2 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 123.779 2.986 . . . . 0.0 114.514 177.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -65.05 -10.52 30.69 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.397 1.079 . . . . 0.0 111.776 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.57 -10.46 51.5 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.049 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.9 m -107.57 155.37 20.19 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.291 0.567 . . . . 0.0 111.435 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -118.85 132.91 56.13 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 173.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 55' ' ' ASN . 18.8 m -128.64 162.38 35.64 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -104.45 132.84 50.12 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.484 ' CG1' HD11 ' A' ' 51' ' ' LEU . 42.8 t -106.46 113.96 44.43 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.178 0 CA-C-O 121.206 0.526 . . . . 0.0 110.015 -178.313 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 24.8 tpp180 -110.38 125.11 52.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.102 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -90.28 120.21 31.23 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 174.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.502 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.03 152.25 50.08 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.683 -176.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo . . . . . 0 C--O 1.245 0.856 0 C-N-CA 122.212 1.941 . . . . 0.0 111.053 176.244 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.422 -1.872 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.6 p -137.36 138.9 40.4 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.528 -179.297 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.554 HG23 ' HE1' ' A' ' 24' ' ' PHE . 41.5 t -107.38 134.98 47.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.467 -179.702 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -82.95 109.68 17.27 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 174.898 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.6 p90 -122.5 134.4 54.57 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -115.74 132.11 56.73 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 117.744 -1.583 . . . . 0.0 109.174 175.78 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.31 155.65 17.4 Favored 'General case' 0 C--N 1.275 -2.645 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -62.62 -25.8 68.29 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.578 0.704 . . . . 0.0 110.655 175.601 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.1 -3.09 50.83 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.984 178.336 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -106.31 172.39 6.84 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.675 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.8 tp -102.1 -45.8 5.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 176.517 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -122.69 -171.01 2.19 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.167 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.9 148.1 34.73 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.496 0.665 . . . . 0.0 111.623 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -114.45 178.51 4.26 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 176.725 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 3.1 p -132.17 131.97 42.75 Favored 'General case' 0 N--CA 1.414 -2.242 0 CA-C-N 118.908 0.776 . . . . 0.0 110.64 -175.505 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.6 p -110.2 130.77 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.191 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 176.404 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -102.03 141.94 34.1 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -174.919 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.9 p90 -155.76 177.38 11.46 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -116.86 155.49 28.93 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.13 -135.64 12.96 Favored Glycine 0 C--N 1.31 -0.912 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 -178.715 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.451 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 2.8 tm? -122.9 -42.84 2.27 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.489 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -136.29 159.01 43.05 Favored 'General case' 0 CA--C 1.478 -1.804 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.662 -177.274 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -121.21 126.71 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.638 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.5 m -57.64 140.53 50.91 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.178 176.659 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 62' ' ' TYR . 50.1 tp -57.87 -40.26 79.78 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 123.17 0.588 . . . . 0.0 112.491 -176.319 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 19.7 t -55.18 -46.92 75.84 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.987 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.622 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -66.03 -47.7 73.56 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.74 179.611 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.91 -46.61 89.97 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 123.561 0.538 . . . . 0.0 112.14 -177.066 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' HD23 ' A' ' 51' ' ' LEU . 50.1 mtmt -66.08 -45.13 82.34 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.302 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -62.0 -35.56 78.89 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.271 0.357 . . . . 0.0 111.1 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 29.3 mm-40 -63.7 -50.6 68.55 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.425 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.6 mt -66.25 -45.57 89.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.566 -176.202 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 67.8 mtm -64.66 -40.5 95.54 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.278 -177.832 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.04 -41.59 47.43 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.235 179.35 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.63 -47.37 63.65 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 17.6 mm-40 -89.55 -2.74 58.43 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt 71.21 65.92 0.16 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 125.153 1.381 . . . . 0.0 111.288 178.825 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.436 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.9 mp -103.38 156.99 17.34 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.124 -0.944 . . . . 0.0 108.582 175.516 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -94.31 100.62 12.63 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 122.005 0.907 . . . . 0.0 109.782 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.08 -17.04 61.0 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.108 -174.105 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -98.2 1.73 47.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 179.718 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -124.3 -28.17 3.7 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.232 -0.987 . . . . 0.0 111.581 -177.423 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.4 p -135.68 159.65 40.98 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.716 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -108.47 157.34 18.53 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -179.657 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.455 HD11 ' CG1' ' A' ' 77' ' ' VAL . 23.6 tp -113.1 116.62 30.16 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.067 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.497 ' HB2' HG12 ' A' ' 80' ' ' ILE . 25.1 tt0 -116.21 115.08 25.35 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 121.806 0.812 . . . . 0.0 109.645 -176.568 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.425 HD12 HG22 ' A' ' 77' ' ' VAL . 27.4 mm -97.25 135.55 31.11 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 -174.293 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 m -121.19 141.36 50.93 Favored 'General case' 0 C--N 1.283 -2.294 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.467 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 12.4 t-20 -75.1 139.75 42.98 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.677 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.0 -28.54 39.42 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.336 0.589 . . . . 0.0 111.173 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -92.09 -49.18 6.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.425 -174.718 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.1 p -93.64 -19.79 20.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.982 0.42 . . . . 0.0 110.129 -174.927 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.2 mmmt 65.75 24.01 11.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.559 1.144 . . . . 0.0 111.139 -178.099 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -82.29 131.3 35.23 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.59 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -90.36 135.27 33.79 Favored 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 177.224 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 63.2 m-85 -101.25 97.12 7.67 Favored 'General case' 0 C--N 1.263 -3.19 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.223 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -100.15 -25.39 14.3 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.985 -177.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -94.07 128.99 40.77 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -176.193 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -61.6 -10.74 8.9 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -91.68 -2.08 57.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.637 -178.363 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.29 151.14 47.35 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.556 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.16 138.94 52.59 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 118.385 0.539 . . . . 0.0 111.007 -177.642 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.48 113.98 36.45 Favored Pre-proline 0 C--N 1.315 -0.93 0 C-N-CA 119.689 -0.805 . . . . 0.0 110.445 173.027 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.564 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.7 Cg_endo -79.43 158.68 25.79 Favored 'Trans proline' 0 CA--C 1.519 -0.256 0 C-N-CA 123.128 2.552 . . . . 0.0 113.245 177.032 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -70.48 5.15 1.92 Allowed 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 121.57 0.7 . . . . 0.0 111.9 176.339 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -87.95 -20.52 25.78 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.023 172.891 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -103.42 141.7 35.52 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -174.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -104.0 128.43 51.56 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 169.199 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 ' HA ' ' A' ' 55' ' ' ASN . 14.6 m -123.17 157.28 28.87 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.7 mm -103.71 125.96 58.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.221 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.455 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.4 t -100.78 114.27 39.26 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-O 121.397 0.617 . . . . 0.0 110.429 -177.515 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -113.11 138.85 49.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.887 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -100.41 128.52 46.45 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.497 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -127.85 153.61 78.09 Favored Pre-proline 0 C--N 1.312 -1.036 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.467 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 CA--C 1.537 0.668 0 C-N-CA 121.977 1.784 . . . . 0.0 111.993 179.012 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 71' ' ' LYS . 36.1 m . . . . . 0 N--CA 1.409 -2.495 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.7 p -139.59 134.84 32.68 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.629 -179.034 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' CE1' ' A' ' 24' ' ' PHE . 59.6 t -107.35 135.67 45.12 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.458 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -83.92 113.32 20.89 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.195 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 29.5 p90 -129.51 136.56 50.0 Favored 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.218 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -121.79 141.01 51.64 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 173.273 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.559 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -91.66 175.87 6.74 Favored 'General case' 0 C--N 1.277 -2.566 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 177.059 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -63.43 -30.65 71.74 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 171.162 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.4 m -79.53 -7.04 58.2 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.682 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.559 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 3.8 mptp? -105.06 134.25 48.48 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.302 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.27 -19.47 22.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.629 0.728 . . . . 0.0 109.226 178.129 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.449 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 8.2 p30 -129.96 173.92 10.25 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.553 179.012 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.89 129.05 36.96 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.268 0.556 . . . . 0.0 112.179 -177.511 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -89.58 177.59 6.51 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.55 -1.205 . . . . 0.0 108.47 175.092 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -135.76 131.49 35.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.169 0.509 . . . . 0.0 110.87 -177.238 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.5 p -113.75 127.54 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.086 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.751 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 7' ' ' SER . 8.5 p -99.83 143.69 29.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.374 0.606 . . . . 0.0 112.142 -176.86 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.532 ' CE1' HG23 ' A' ' 9' ' ' VAL . 17.2 p90 -153.23 171.03 19.14 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.157 178.014 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.14 135.33 51.82 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.12 -115.02 2.08 Favored Glycine 0 C--N 1.302 -1.341 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.548 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tt -149.14 -41.11 0.15 Allowed 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 1.1 p-80 -134.81 157.25 47.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 179.521 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 tt -122.78 125.67 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.993 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.553 -179.014 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.1 m -58.23 141.25 51.29 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.908 173.461 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.449 HD11 HD13 ' A' ' 53' ' ' ILE . 57.9 tp -54.63 -41.23 69.78 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.918 1.287 . . . . 0.0 111.409 -177.435 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.654 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 53.7 t -54.33 -45.24 72.63 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.452 178.198 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -72.63 -43.07 63.72 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 -176.562 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.499 ' CD2' HD13 ' A' ' 69' ' ' ILE . 0.6 OUTLIER -67.02 -40.85 87.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.24 -174.477 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.456 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 53.1 mtmt -62.36 -38.82 91.0 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.782 -179.431 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.654 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 3.9 mptp? -61.75 -40.42 95.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.638 177.876 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -63.18 -51.1 67.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.783 179.435 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.6 mt -68.81 -42.83 82.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.418 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.428 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.2 mtm -64.0 -35.25 80.07 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.384 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.5 -39.16 50.87 Favored Glycine 0 C--N 1.309 -0.924 0 C-N-CA 120.308 -0.948 . . . . 0.0 111.541 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -66.77 -43.41 84.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.893 0.877 . . . . 0.0 112.549 -177.05 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 76.5 mm-40 -99.95 3.61 44.46 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.882 0.373 . . . . 0.0 110.993 -178.741 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.4 mptt 57.86 66.51 1.11 Allowed 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.387 178.11 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -98.85 154.23 18.18 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.179 177.564 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 47' ' ' ALA . 23.7 ttmm -97.69 111.62 23.83 Favored 'General case' 0 N--CA 1.401 -2.893 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.795 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.98 -1.69 26.89 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.794 -178.37 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.33 -12.06 18.94 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.377 -177.038 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.89 -37.06 6.8 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.392 0.615 . . . . 0.0 110.323 -177.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.7 m -141.43 174.36 10.62 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.441 -178.442 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -119.44 169.87 9.65 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.9 tp -114.52 122.26 46.02 Favored 'General case' 0 C--N 1.273 -2.76 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.447 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -113.55 123.34 49.76 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -177.113 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.498 HG12 HD11 ' A' ' 34' ' ' LEU . 2.1 mp -102.94 132.11 49.8 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.84 0 C-N-CA 119.867 -0.733 . . . . 0.0 109.115 179.204 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.4 m -117.27 146.92 42.99 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 179.376 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.542 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.7 t-20 -74.59 138.6 43.11 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' HG13 ' A' ' 76' ' ' ILE . . . -76.88 -25.77 53.43 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-O 121.211 0.529 . . . . 0.0 110.379 -178.419 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -92.78 -56.52 2.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.553 -176.494 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.5 p -90.83 -16.27 28.57 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.248 -171.91 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 64.03 18.44 11.22 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -174.183 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.18 125.89 28.08 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 175.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -89.51 125.67 35.28 Favored 'General case' 0 C--N 1.288 -2.094 0 CA-C-O 121.298 0.57 . . . . 0.0 110.676 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -92.61 100.15 12.73 Favored 'General case' 0 C--N 1.278 -2.507 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.678 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.4 p -98.2 -26.09 14.67 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.743 -175.577 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -95.35 135.54 36.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.2 m-20 -64.19 -17.85 63.93 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.493 0.717 . . . . 0.0 110.784 -178.073 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -81.64 -8.75 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.727 -178.597 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.83 144.36 56.66 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.624 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.73 137.68 52.53 Favored 'General case' 0 C--N 1.294 -1.835 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -176.805 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.499 HD13 ' CD2' ' A' ' 34' ' ' LEU . 3.8 mp -119.69 116.48 33.16 Favored Pre-proline 0 C--N 1.302 -1.477 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.236 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.525 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 75.8 Cg_endo -80.75 160.8 21.64 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.373 2.716 . . . . 0.0 113.879 177.735 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 7' ' ' SER . 53.4 pttt -63.79 -8.74 11.58 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.93 175.504 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -81.48 -17.38 48.88 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.646 178.766 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 37.8 m -105.81 152.74 22.85 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.784 0.802 . . . . 0.0 111.856 -175.151 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 m -114.45 129.75 56.68 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 170.184 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.652 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.6 m -128.57 164.28 30.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 120.909 0.385 . . . . 0.0 110.917 -176.362 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 56' ' ' ALA . 51.0 mt -122.8 129.04 75.43 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 53' ' ' ILE . 20.3 t -100.39 132.62 45.67 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.468 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.089 -173.091 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -130.26 143.16 50.61 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 -176.098 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -97.36 134.07 41.12 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.596 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 pp -124.77 148.9 60.88 Favored Pre-proline 0 C--N 1.303 -1.429 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.934 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 N--CA 1.447 -1.254 0 C-N-CA 122.188 1.925 . . . . 0.0 111.713 178.761 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.4 m . . . . . 0 N--CA 1.405 -2.684 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.543 ' SG ' HG22 ' A' ' 23' ' ' THR . 83.8 m -138.38 133.51 33.0 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.917 -174.479 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.55 HG23 ' CE1' ' A' ' 24' ' ' PHE . 79.1 t -106.14 130.52 57.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 42.7 m-70 -88.63 120.17 29.78 Favored 'General case' 0 CA--C 1.482 -1.652 0 O-C-N 124.227 0.954 . . . . 0.0 109.106 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.632 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.1 p90 -132.95 139.93 47.56 Favored 'General case' 0 C--N 1.278 -2.515 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.22 148.49 43.62 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.536 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -85.97 165.45 16.72 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.957 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -66.08 -30.9 71.5 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.41 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.2 t -74.34 -57.11 4.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.87 176.422 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 13' ' ' PHE . 54.5 mtmt -67.4 143.22 56.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.094 0.557 . . . . 0.0 111.7 -178.555 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.15 -37.65 14.05 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.162 -175.178 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -100.76 163.23 12.42 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.528 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -87.94 152.17 22.26 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.374 0.607 . . . . 0.0 111.553 -177.928 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.47 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.8 t70 -121.71 176.69 5.59 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 176.449 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 4.6 p -133.33 131.17 39.81 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.667 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -95.5 117.33 39.26 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.165 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 170.157 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.543 HG22 ' SG ' ' A' ' 8' ' ' CYS . 39.9 p -86.01 121.41 28.59 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.406 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.566 ' O ' ' HB2' ' A' ' 7' ' ' SER . 16.0 p90 -143.24 161.6 37.85 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -178.106 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -101.13 132.51 46.57 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.0 -163.39 23.49 Favored Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -177.524 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 58.0 tp -106.97 -35.52 6.88 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 176.922 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.532 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -144.3 156.94 44.48 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.261 -179.242 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -126.14 131.15 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.91 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.432 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.8 m -64.98 145.54 56.2 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.131 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 47.6 tp -54.87 -46.27 74.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -172.672 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.491 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 12.7 t -58.57 -42.73 88.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 118.994 0.815 . . . . 0.0 109.87 179.412 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 6.1 m-20 -65.06 -43.51 92.0 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.132 179.193 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.29 -46.34 90.17 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.893 -179.685 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 52.4 mtmt -66.78 -40.57 88.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 -179.92 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.2 mptt -61.87 -34.41 75.96 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.668 178.116 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 13.3 mm100 -65.4 -50.1 66.75 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 110.102 176.115 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.3 mt -68.61 -47.13 78.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.604 -176.689 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.0 mtm -63.09 -44.3 96.11 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.17 -178.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -39.03 91.56 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.834 179.009 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.03 -51.51 63.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.085 0.469 . . . . 0.0 110.745 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -97.43 11.26 37.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -171.366 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt 67.67 38.89 2.88 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.426 1.09 . . . . 0.0 112.036 171.977 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.07 167.34 22.05 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.388 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -105.47 102.43 11.9 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.681 178.762 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.62 -13.7 60.04 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.52 -176.792 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.58 -6.85 59.12 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.871 -179.1 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -126.62 -33.08 2.57 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.511 0.672 . . . . 0.0 111.107 178.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.3 m -129.27 161.71 29.58 Favored 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.337 -175.867 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -118.81 171.26 8.34 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 178.171 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.464 HD11 ' CG1' ' A' ' 77' ' ' VAL . 18.2 tp -118.48 117.69 29.71 Favored 'General case' 0 N--CA 1.395 -3.193 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -174.067 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.482 HE21 HG22 ' A' ' 63' ' ' THR . 1.2 tp60 -101.4 123.53 45.62 Favored 'General case' 0 C--N 1.284 -2.249 0 O-C-N 120.932 -1.105 . . . . 0.0 108.408 -177.714 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 51' ' ' LEU . 32.8 mm -110.23 130.67 63.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -173.222 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.7 m -117.13 139.48 50.68 Favored 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.371 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.8 t-20 -65.79 136.5 56.28 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 176.031 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.33 -26.18 55.51 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.254 0.549 . . . . 0.0 111.427 -177.41 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -95.69 -52.2 4.2 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.28 -176.605 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -90.16 -18.61 25.47 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.25 0.548 . . . . 0.0 110.223 -174.112 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 66.05 21.83 11.21 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.731 1.212 . . . . 0.0 112.153 -177.239 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -70.72 121.63 18.32 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.597 174.836 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -90.18 117.98 29.35 Favored 'General case' 0 N--CA 1.405 -2.723 0 CA-C-O 122.0 0.905 . . . . 0.0 110.838 -178.06 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -87.63 92.84 9.25 Favored 'General case' 0 C--N 1.272 -2.767 0 CA-C-N 114.101 -1.408 . . . . 0.0 107.75 -179.583 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.482 HG22 HE21 ' A' ' 52' ' ' GLN . 23.8 p -93.23 -17.77 23.28 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.375 -176.982 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -101.55 128.82 47.63 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.388 -178.169 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 7.8 p-10 -67.72 -7.08 24.23 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.501 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -90.79 -2.87 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.447 176.289 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.2 150.56 47.34 Favored 'General case' 0 C--O 1.206 -1.205 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.203 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.532 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.04 138.33 52.29 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 118.085 0.402 . . . . 0.0 110.84 -177.071 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.28 116.04 37.63 Favored Pre-proline 0 C--N 1.314 -0.956 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.563 176.11 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.0 Cg_endo -79.39 158.77 25.96 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 123.162 2.574 . . . . 0.0 113.418 176.036 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -66.67 -10.26 44.49 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.659 178.194 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -87.77 -3.88 58.92 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.386 178.945 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -112.59 150.88 30.76 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 121.261 0.553 . . . . 0.0 111.476 -178.091 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -109.73 126.7 54.0 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.213 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 13.9 m -124.57 164.77 22.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.424 0.63 . . . . 0.0 112.553 -176.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -124.3 136.07 61.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 C-N-CA 124.295 1.038 . . . . 0.0 108.728 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.464 ' CG1' HD11 ' A' ' 51' ' ' LEU . 41.2 t -104.17 129.28 56.69 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.612 -172.323 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -129.01 140.65 51.55 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.311 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -98.64 131.94 44.43 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.607 178.789 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -128.93 152.84 79.82 Favored Pre-proline 0 C--O 1.206 -1.199 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.029 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 C--N 1.318 -1.069 0 C-N-CA 122.308 2.006 . . . . 0.0 111.579 177.985 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.474 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 64.1 m . . . . . 0 N--CA 1.412 -2.357 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 27.3 p -144.25 144.48 31.53 Favored 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.531 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.2 t -105.57 132.43 52.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.331 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -82.84 104.7 13.26 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.761 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CD2' HG21 ' A' ' 77' ' ' VAL . 38.2 p90 -120.71 141.23 50.62 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 -177.426 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -124.51 126.09 45.29 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 118.102 -1.439 . . . . 0.0 110.164 175.685 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.26 157.2 19.99 Favored 'General case' 0 C--N 1.286 -2.166 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 178.176 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.7 m -60.0 -25.06 64.97 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 120.809 0.338 . . . . 0.0 111.53 177.479 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 t -95.1 -4.75 45.69 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 121.549 0.69 . . . . 0.0 110.615 178.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.24 -43.3 11.08 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 121.712 -0.618 . . . . 0.0 110.642 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 71.89 -47.31 0.66 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.478 1.511 . . . . 0.0 111.722 -176.492 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -100.92 169.44 8.97 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 175.42 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -83.36 144.96 29.31 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.536 0.684 . . . . 0.0 112.059 -176.94 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -113.91 177.97 4.45 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 176.012 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.68 123.0 17.05 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.519 0.599 . . . . 0.0 110.875 -174.005 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -102.36 119.68 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 176.696 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 p -87.58 134.52 33.61 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.138 -178.731 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.531 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.7 p90 -144.79 176.0 9.77 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.715 -177.287 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -103.9 131.19 51.37 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.73 179.83 20.88 Favored Glycine 0 C--O 1.209 -1.407 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.338 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -83.49 -31.62 26.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.54 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -136.93 157.35 46.95 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.58 -177.862 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.06 132.48 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.783 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.573 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.461 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 6.3 m -60.83 145.49 49.72 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.408 0.683 . . . . 0.0 109.976 177.139 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.9 tp -57.7 -43.1 84.94 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 124.134 0.974 . . . . 0.0 112.729 -176.306 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.5 t -59.13 -45.6 90.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.222 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.636 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 14.1 m-20 -62.71 -48.77 77.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.824 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.13 -46.54 89.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.405 -176.732 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 39' ' ' MET . 45.6 mtmt -65.46 -44.41 87.29 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.602 -179.151 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.3 mptt -61.92 -33.45 74.28 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 116.72 -0.218 . . . . 0.0 111.263 178.251 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 24.5 mm-40 -63.76 -49.83 71.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.9 mt -67.4 -49.43 71.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.439 -177.339 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 93.6 mtp -61.68 -44.91 96.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.497 -175.282 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.72 61.54 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.305 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -72.74 -51.03 20.87 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.32 0.581 . . . . 0.0 111.628 -177.947 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -87.04 -9.47 55.41 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -170.746 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt 76.66 67.06 0.05 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 124.683 1.193 . . . . 0.0 111.654 -179.787 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -104.12 129.48 51.83 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 173.684 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.57 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 23.9 ttmm -77.67 112.7 14.76 Favored 'General case' 0 N--CA 1.408 -2.573 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.256 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -0.9 30.27 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.079 -178.761 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.452 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -103.03 3.24 35.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.487 0.66 . . . . 0.0 109.297 178.849 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.57 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 23.0 t70 -118.59 -51.13 2.4 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.407 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.3 m -134.05 168.04 19.54 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.064 179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -113.6 169.47 8.95 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 -179.773 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.563 HD11 ' CG1' ' A' ' 77' ' ' VAL . 26.2 tp -116.78 125.32 51.44 Favored 'General case' 0 C--N 1.271 -2.832 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.953 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.567 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -115.99 136.5 52.98 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -179.576 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.468 HD12 HG22 ' A' ' 77' ' ' VAL . 39.0 mm -121.87 135.59 61.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -176.428 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.2 m -128.77 144.51 51.19 Favored 'General case' 0 C--O 1.196 -1.741 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 176.697 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.539 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.6 t-20 -72.95 138.43 46.11 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.737 -0.602 . . . . 0.0 109.869 179.679 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.86 -26.19 49.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.237 0.541 . . . . 0.0 111.015 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -94.69 -52.41 4.3 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.475 -176.245 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 p -90.88 -16.27 28.47 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.202 0.525 . . . . 0.0 110.47 -172.959 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 66.01 21.79 11.26 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.962 -179.522 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -83.61 130.92 34.99 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.417 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.25 143.94 33.29 Favored 'General case' 0 N--CA 1.416 -2.14 0 CA-C-O 121.024 0.44 . . . . 0.0 110.151 174.281 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 91.7 m-85 -103.92 99.06 8.82 Favored 'General case' 0 C--N 1.273 -2.74 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.04 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.2 p -91.32 -27.24 18.52 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.804 -173.863 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -101.34 143.58 31.21 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.5 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.3 p-10 -74.35 -11.07 60.15 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.733 0.301 . . . . 0.0 111.785 -177.454 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -3.46 58.83 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.703 178.281 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.86 58.66 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 174.543 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.54 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.52 137.74 52.36 Favored 'General case' 0 C--N 1.289 -2.051 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.338 -174.685 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.27 117.37 34.91 Favored Pre-proline 0 C--N 1.306 -1.303 0 C-N-CA 119.616 -0.833 . . . . 0.0 110.551 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 55.7 Cg_endo -76.86 152.76 32.62 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.374 2.716 . . . . 0.0 113.244 175.949 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.474 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 42.4 pttt -57.69 -22.2 44.84 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -86.95 -1.75 58.08 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 120.961 0.41 . . . . 0.0 111.756 -177.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -106.9 147.23 30.05 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 -178.424 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.4 p -109.13 124.39 50.73 Favored 'General case' 0 N--CA 1.424 -1.727 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 55' ' ' ASN . 15.9 m -123.39 149.98 27.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.569 0.7 . . . . 0.0 112.65 -177.44 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.6 mm -94.18 126.07 46.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 178.876 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.563 ' CG1' HD11 ' A' ' 51' ' ' LEU . 59.7 t -106.51 122.03 59.88 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -177.152 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -126.04 134.41 51.44 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.24 -173.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -90.27 116.78 28.5 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.419 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.77 150.52 48.54 Favored Pre-proline 0 C--N 1.308 -1.226 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.276 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--N 1.325 -0.668 0 C-N-CA 122.182 1.922 . . . . 0.0 111.876 -179.086 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 m . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.9 p -149.6 145.29 26.7 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 119.681 -0.808 . . . . 0.0 110.896 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.0 t -107.02 128.74 61.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.341 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.444 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 21.6 m-70 -77.68 105.54 8.91 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 173.89 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.559 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 33.7 p90 -123.41 140.82 52.62 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -178.305 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -117.02 137.77 52.02 Favored 'General case' 0 C--N 1.286 -2.182 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 172.158 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.459 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 2.2 t80 -89.9 166.69 13.35 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -178.66 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.4 t -58.94 -31.5 68.74 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.627 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 m -84.6 -7.07 59.38 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.31 -179.982 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.459 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 95.6 mttt -116.87 124.38 49.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.422 0.629 . . . . 0.0 110.67 -177.12 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -81.93 -20.57 38.4 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.651 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -114.01 164.69 13.47 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.372 -0.831 . . . . 0.0 108.8 179.852 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -83.94 148.22 27.04 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 121.87 0.843 . . . . 0.0 111.601 -179.586 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.8 t0 -120.0 178.04 4.76 Favored 'General case' 0 C--N 1.279 -2.463 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -134.85 128.52 32.85 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 118.209 0.459 . . . . 0.0 110.07 -175.536 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.552 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.3 p -106.9 122.26 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.144 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.2 p -89.41 135.31 33.66 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -177.595 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.478 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.1 p90 -146.73 165.61 29.12 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -176.905 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -95.55 111.05 23.04 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 123.953 0.783 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.74 -174.17 20.26 Favored Glycine 0 C--N 1.298 -1.539 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 tt -95.27 -26.87 15.77 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 177.434 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.3 OUTLIER -143.31 151.76 40.88 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.465 178.699 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.5 tt -125.91 135.06 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.925 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.622 -177.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -62.17 141.75 58.01 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.383 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.557 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 52.1 tp -57.1 -43.22 82.03 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 123.502 0.721 . . . . 0.0 112.404 -175.616 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.532 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.4 t -56.45 -45.32 80.87 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.061 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -65.32 -42.06 93.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.376 179.616 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.61 -46.53 87.85 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 -179.48 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 44.7 mtmt -66.02 -40.43 91.07 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.248 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.89 -39.47 92.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.303 176.439 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -65.34 -50.72 64.54 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.629 177.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 75.7 mt -62.76 -48.29 88.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 123.562 0.539 . . . . 0.0 111.986 -177.554 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.6 mtm -64.72 -37.3 87.12 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.635 -178.991 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.91 64.14 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.188 -1.006 . . . . 0.0 111.36 177.182 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -63.51 -45.1 92.2 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.173 0.989 . . . . 0.0 111.658 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 31.7 mt-10 -103.39 3.33 35.01 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.907 -176.987 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.27 66.13 0.91 Allowed 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 124.614 1.166 . . . . 0.0 111.664 178.052 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.5 mp -98.69 135.09 40.69 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.597 177.553 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 39.4 ttmt -77.79 108.33 10.94 Favored 'General case' 0 N--CA 1.414 -2.247 0 CA-C-O 121.45 0.643 . . . . 0.0 109.951 179.143 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.55 1.67 25.02 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.16 179.263 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.429 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.17 -0.88 35.23 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.65 0.738 . . . . 0.0 109.852 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.5 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 12.2 t70 -115.68 -36.33 4.25 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.001 -1.0 . . . . 0.0 108.412 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 17.1 p -143.32 168.68 19.23 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.962 -174.938 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -116.12 169.38 9.31 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 177.67 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.531 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.4 tp -120.32 123.01 42.08 Favored 'General case' 0 C--N 1.259 -3.342 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 -178.401 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.576 ' HB2' HG12 ' A' ' 80' ' ' ILE . 41.9 tt0 -115.54 119.21 35.4 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -175.326 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.435 HG13 HG22 ' A' ' 77' ' ' VAL . 1.7 mp -105.87 132.56 52.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 CA-C-O 121.407 0.622 . . . . 0.0 111.032 -176.138 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.4 m -113.94 148.63 36.5 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.344 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.534 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -75.35 141.81 43.27 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 175.86 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.34 -28.33 42.04 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 0.0 110.989 -178.824 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -93.89 -53.33 4.04 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.384 -175.716 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -84.95 -22.47 29.19 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -174.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 65.57 23.07 11.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.408 -175.833 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.47 132.18 36.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.226 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -91.15 117.11 29.35 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-O 121.505 0.669 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -86.77 93.72 9.34 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.405 HG22 HE21 ' A' ' 52' ' ' GLN . 19.3 p -92.42 -10.01 39.56 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.492 -177.413 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.647 ' HB3' ' OD1' ' A' ' 66' ' ' ASN . 10.5 m-20 -101.73 132.09 47.64 Favored 'General case' 0 CA--C 1.479 -1.769 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.837 176.111 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.46 0.22 30.39 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.269 0.557 . . . . 0.0 111.666 -178.786 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.647 ' OD1' ' HB3' ' A' ' 64' ' ' ASP . 2.7 p-10 -90.66 1.8 56.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.797 178.337 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.31 154.47 40.94 Favored 'General case' 0 C--O 1.208 -1.091 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.685 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.45 137.39 53.2 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.68 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.42 116.68 33.44 Favored Pre-proline 0 C--N 1.302 -1.46 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.396 177.009 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -80.15 155.94 22.75 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.294 2.662 . . . . 0.0 113.75 176.559 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 13.6 ptmt -58.3 -21.43 49.01 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.825 178.084 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -87.11 -1.25 57.75 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 120.818 0.342 . . . . 0.0 111.6 -177.617 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.6 m -112.81 149.03 33.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.424 -178.48 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.4 p -109.39 132.49 54.08 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.989 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.9 m -132.03 160.76 42.24 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 121.405 0.621 . . . . 0.0 112.556 -177.544 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -108.53 125.57 65.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 179.71 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 51' ' ' LEU . 43.3 t -104.86 109.72 28.51 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-O 121.517 0.675 . . . . 0.0 109.759 -177.244 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -113.58 129.16 56.61 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.255 -175.435 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.579 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 56.5 ttp180 -91.6 129.87 37.5 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -179.213 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.576 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -130.38 153.3 81.28 Favored Pre-proline 0 C--N 1.309 -1.189 0 C-N-CA 121.116 -0.234 . . . . 0.0 110.413 -175.653 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 CA--C 1.539 0.734 0 C-N-CA 121.931 1.754 . . . . 0.0 111.122 178.103 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.783 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -63.71 114.72 2.69 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.218 1.945 . . . . 0.0 110.954 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp -71.38 123.29 21.99 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.8 -116.07 0.75 Allowed Glycine 0 N--CA 1.425 -2.089 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 m -93.02 2.0 57.01 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 121.461 0.648 . . . . 0.0 111.297 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.439 ' CE ' ' HA ' ' A' ' 6' ' ' MET . 2.0 mmt -92.73 150.72 20.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.265 0.555 . . . . 0.0 110.179 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 55.3 m -136.59 120.2 17.17 Favored 'General case' 0 N--CA 1.413 -2.32 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.551 ' SG ' HG22 ' A' ' 23' ' ' THR . 58.0 m -125.86 128.93 48.38 Favored 'General case' 0 C--N 1.291 -1.945 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.195 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' CE1' ' A' ' 24' ' ' PHE . 25.3 t -108.11 124.66 64.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.853 175.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -81.29 105.98 12.91 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.03 -0.987 . . . . 0.0 108.377 173.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.583 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.0 p90 -118.6 126.01 51.03 Favored 'General case' 0 C--N 1.278 -2.535 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.14 133.07 50.53 Favored 'General case' 0 C--N 1.278 -2.515 0 C-N-CA 118.536 -1.265 . . . . 0.0 107.688 176.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.402 ' HA ' ' HB ' ' A' ' 77' ' ' VAL . 1.0 OUTLIER -82.93 150.52 26.39 Favored 'General case' 0 C--N 1.282 -2.333 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 p -64.43 -24.79 67.75 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.43 0.633 . . . . 0.0 110.648 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 m -80.47 -15.59 56.39 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.861 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.443 ' HB3' ' OD1' ' A' ' 18' ' ' ASN . 82.3 mttt -104.44 157.78 16.93 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.82 0.819 . . . . 0.0 112.492 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -96.74 1.24 50.68 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.054 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.443 ' OD1' ' HB3' ' A' ' 16' ' ' LYS . 30.3 p-10 -145.6 164.91 30.25 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.787 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -91.82 139.4 30.71 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.04 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.17 177.62 4.75 Favored 'General case' 0 C--N 1.279 -2.46 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -144.26 120.83 11.08 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -172.198 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.431 HG13 ' CE1' ' A' ' 11' ' ' TYR . 1.9 m -95.23 126.83 47.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.551 HG22 ' SG ' ' A' ' 8' ' ' CYS . 10.8 p -98.93 118.19 35.15 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.471 ' CE1' HG23 ' A' ' 9' ' ' VAL . 43.4 p90 -131.46 175.59 9.02 Favored 'General case' 0 C--N 1.281 -2.394 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.624 -178.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -107.81 150.34 27.12 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.876 0.735 . . . . 0.0 109.799 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.41 -114.74 4.2 Favored Glycine 0 N--CA 1.42 -2.398 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tt -152.58 -41.08 0.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.541 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -133.49 152.63 51.93 Favored 'General case' 0 CA--C 1.49 -1.364 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.954 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -117.9 127.34 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.574 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.97 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.4 m -63.09 140.29 58.86 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 62' ' ' TYR . 59.5 tp -54.64 -39.23 67.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 124.64 1.176 . . . . 0.0 112.561 -175.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.679 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -54.38 -46.91 73.16 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -74.93 -36.86 62.15 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.821 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.9 -47.34 85.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.721 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.7 mtmt -71.69 -44.92 63.37 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.644 -178.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.679 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.2 mptt -61.38 -35.16 76.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.273 -0.422 . . . . 0.0 112.023 -178.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.39 -49.66 62.97 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 120.481 -0.488 . . . . 0.0 109.891 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -64.97 -42.33 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.971 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 57.4 mtt -59.78 -44.89 93.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.696 0.284 . . . . 0.0 111.237 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.07 -31.01 62.25 Favored Glycine 0 C--N 1.317 -0.491 0 CA-C-O 121.664 0.591 . . . . 0.0 112.058 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.7 ttt85 -69.32 -51.28 38.65 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 123.766 0.826 . . . . 0.0 111.646 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 40.0 mm-40 -92.98 -14.23 27.73 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -172.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp 77.75 72.3 0.06 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 125.657 1.583 . . . . 0.0 111.236 -177.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.9 mp -101.0 153.85 19.19 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.089 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.638 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.96 101.88 14.23 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.666 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.02 -12.56 59.69 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.443 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.39 -15.71 57.42 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.23 177.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -117.26 -31.31 5.34 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.588 0.709 . . . . 0.0 110.606 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.0 m -129.2 165.25 21.71 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-O 122.295 1.045 . . . . 0.0 113.787 -172.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.459 ' HB3' HD11 ' A' ' 80' ' ' ILE . 49.5 t0 -123.08 169.66 10.97 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 173.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 35' ' ' LYS . 14.2 tp -115.34 120.09 38.48 Favored 'General case' 0 C--N 1.257 -3.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.564 ' HB2' HG12 ' A' ' 80' ' ' ILE . 47.8 tp60 -106.49 123.45 48.1 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-O 121.267 0.556 . . . . 0.0 109.604 -176.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 77' ' ' VAL . 19.8 mm -114.29 135.43 54.07 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -172.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.5 m -125.89 140.78 52.36 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.601 ' HA ' HG12 ' A' ' 75' ' ' VAL . 9.5 t-20 -72.55 138.22 46.76 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.28 -16.56 34.81 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.436 0.636 . . . . 0.0 110.723 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -99.17 -44.51 6.24 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.842 -173.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -100.38 -19.08 16.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.191 0.519 . . . . 0.0 110.254 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.9 mmmm 71.96 12.45 6.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.051 1.341 . . . . 0.0 112.155 -177.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.1 135.35 46.22 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.059 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -92.86 145.26 24.53 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.296 0.57 . . . . 0.0 110.544 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.432 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 82.3 m-85 -105.18 98.01 7.77 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -90.56 -37.67 13.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -101.17 150.59 22.79 Favored 'General case' 0 CA--C 1.495 -1.17 0 C-N-CA 120.482 -0.487 . . . . 0.0 109.831 -177.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.606 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -64.32 -15.21 59.87 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.08 -11.17 58.25 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -62.19 141.19 58.32 Favored 'General case' 0 C--O 1.19 -2.038 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 -178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.541 HD13 ' CG ' ' A' ' 28' ' ' HIS . 2.8 pp -117.2 137.72 52.17 Favored 'General case' 0 C--N 1.289 -2.065 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.137 -171.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.34 112.53 43.76 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 48.8 Cg_endo -78.0 156.63 30.51 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 C-N-CA 122.803 2.335 . . . . 0.0 112.865 175.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 47.9 pttt -58.24 -17.5 19.7 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.429 0.692 . . . . 0.0 112.535 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -82.71 -1.95 52.8 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.918 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.436 ' HB3' HD21 ' A' ' 55' ' ' ASN . 35.1 m -115.46 118.61 33.67 Favored 'General case' 0 N--CA 1.424 -1.773 0 O-C-N 122.221 -0.3 . . . . 0.0 111.371 -177.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 m -89.8 123.21 33.58 Favored 'General case' 0 N--CA 1.425 -1.689 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.601 HG12 ' HA ' ' A' ' 55' ' ' ASN . 25.9 m -121.39 160.03 23.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 CA-C-O 120.945 0.402 . . . . 0.0 111.783 -172.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.7 mm -107.5 133.97 50.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 53' ' ' ILE . 57.3 t -106.44 117.75 52.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.444 -176.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -114.46 137.28 52.04 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -92.74 124.64 36.89 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.548 -0.72 . . . . 0.0 109.666 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.564 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -125.89 149.34 65.66 Favored Pre-proline 0 C--O 1.206 -1.202 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.144 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.79 141.06 33.16 Favored 'Trans proline' 0 C--N 1.32 -0.963 0 C-N-CA 122.297 1.998 . . . . 0.0 111.827 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.437 HG13 ' H ' ' A' ' 83' ' ' GLY . 3.9 pt -69.69 -68.13 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.437 ' H ' HG13 ' A' ' 82' ' ' ILE . . . -168.89 55.73 0.21 Allowed Glycine 0 CA--C 1.49 -1.485 0 C-N-CA 120.023 -1.084 . . . . 0.0 111.411 -178.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.42 -79.46 0.07 OUTLIER Glycine 0 CA--C 1.468 -2.892 0 N-CA-C 107.528 -2.229 . . . . 0.0 107.528 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.4 m -77.7 140.49 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 170.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt . . . . . 0 C--N 1.281 -2.38 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.664 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.63 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -93.95 -157.01 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.349 0 C-N-CA 122.97 2.447 . . . . 0.0 107.942 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.55 101.83 0.65 Allowed 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.35 106.88 3.43 Favored Glycine 0 N--CA 1.416 -2.691 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -177.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.0 t -90.43 14.69 12.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.8 ptp -56.95 157.54 5.63 Favored 'General case' 0 CA--C 1.498 -1.056 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.279 176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 73.4 m -127.09 123.32 36.61 Favored 'General case' 0 N--CA 1.392 -3.372 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.899 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.1 p -139.04 135.66 34.46 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.385 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.596 HG23 ' CE1' ' A' ' 24' ' ' PHE . 69.1 t -105.19 129.57 57.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -82.97 115.76 21.95 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.91 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.597 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 51.0 p90 -133.66 142.01 47.85 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -120.25 136.99 54.47 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 118.331 -1.348 . . . . 0.0 108.124 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -83.96 174.63 10.18 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -56.55 -37.31 70.35 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.157 0.583 . . . . 0.0 112.482 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.3 m -90.96 1.68 56.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.185 0.517 . . . . 0.0 111.498 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 1.4 mptm? -98.13 127.32 44.0 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.496 0.665 . . . . 0.0 111.615 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.8 tp -91.4 -21.65 20.87 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.964 -1.016 . . . . 0.0 108.341 175.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.22 149.11 46.76 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.011 -1.449 . . . . 0.0 108.954 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -78.16 147.2 34.64 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.422 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 28.4 m-20 -101.11 173.87 6.26 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.9 p -136.15 132.35 35.9 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -102.33 126.15 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 169.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.9 p -94.51 129.54 41.26 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.596 ' CE1' HG23 ' A' ' 9' ' ' VAL . 32.3 p90 -145.99 158.68 43.87 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -95.35 132.9 39.88 Favored 'General case' 0 C--N 1.296 -1.752 0 C-N-CA 119.994 -0.683 . . . . 0.0 111.072 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.92 -146.93 17.39 Favored Glycine 0 N--CA 1.437 -1.297 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.37 -41.95 2.58 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.5 OUTLIER -131.53 152.74 50.49 Favored 'General case' 0 CA--C 1.479 -1.764 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.264 177.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.529 ' HB ' ' CD2' ' A' ' 24' ' ' PHE . 12.4 tt -119.34 126.09 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.732 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.262 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.1 m -55.54 142.31 33.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.492 ' HG ' ' HE2' ' A' ' 35' ' ' LYS . 60.0 tp -58.36 -38.08 76.5 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.749 0.82 . . . . 0.0 112.309 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 35.6 t -56.18 -46.92 79.18 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 30.3 t70 -69.91 -37.89 76.11 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.291 -174.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.07 -46.53 67.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.781 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HE2' ' HG ' ' A' ' 31' ' ' LEU . 51.9 mtmt -66.03 -40.06 90.72 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.357 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -64.02 -35.2 79.93 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 123.552 0.532 . . . . 0.0 111.163 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 94.6 mt-30 -65.0 -47.21 78.33 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.65 -44.73 93.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.258 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 54.5 mtt -60.12 -43.83 95.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.673 0.273 . . . . 0.0 110.465 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -33.12 73.22 Favored Glycine 0 C--N 1.317 -0.525 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.54 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -70.97 -51.25 26.77 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.988 0.423 . . . . 0.0 111.186 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -84.57 -6.59 59.38 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.427 -172.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 7.6 mmmm 67.03 46.97 1.45 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 3.6 tp -83.3 115.61 22.06 Favored 'General case' 0 N--CA 1.411 -2.406 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.095 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.686 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.49 109.9 8.35 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-O 121.711 0.767 . . . . 0.0 110.289 177.432 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.31 58.16 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.787 -174.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.91 -1.71 57.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.556 0.694 . . . . 0.0 110.125 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.482 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 22.0 t70 -108.99 -51.65 2.86 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.794 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.7 m -140.01 164.62 29.53 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.446 0.641 . . . . 0.0 111.91 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.533 ' HB2' ' HA ' ' A' ' 82' ' ' ILE . 7.4 t70 -108.61 170.57 7.94 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' CG1' ' A' ' 77' ' ' VAL . 17.5 tp -118.58 112.5 19.95 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-O 121.334 0.588 . . . . 0.0 109.847 -172.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.449 ' HB2' HG12 ' A' ' 80' ' ' ILE . 19.0 tt0 -101.91 125.67 48.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.4 mm -113.21 132.7 61.32 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -126.39 141.24 51.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 122.338 -0.226 . . . . 0.0 110.43 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.519 ' HA ' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -59.52 124.24 19.43 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 122.856 0.462 . . . . 0.0 110.79 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.88 -28.91 64.89 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.79 -48.21 7.4 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.474 -0.785 . . . . 0.0 112.898 -175.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.9 p -103.83 -8.04 20.07 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.292 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 59.3 25.13 13.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.71 126.17 30.6 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -91.25 137.71 32.15 Favored 'General case' 0 C--N 1.287 -2.109 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -103.9 106.61 17.17 Favored 'General case' 0 C--N 1.278 -2.503 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.0 p -101.94 -17.9 15.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.021 -175.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' HD23 ' A' ' 31' ' ' LEU . 5.2 t70 -106.18 139.78 40.16 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.201 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.676 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -62.75 -16.48 57.93 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 122.886 0.474 . . . . 0.0 111.969 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.37 -10.36 59.4 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.472 0.309 . . . . 0.0 111.479 -178.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.21 150.22 47.71 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.514 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.523 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -118.86 138.29 52.84 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 118.655 0.661 . . . . 0.0 111.225 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -121.19 117.17 30.73 Favored Pre-proline 0 C--N 1.316 -0.86 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.507 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 58.7 Cg_endo -76.67 154.89 35.13 Favored 'Trans proline' 0 C--N 1.332 -0.293 0 C-N-CA 123.148 2.565 . . . . 0.0 113.66 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.45 -8.61 55.94 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 122.092 0.949 . . . . 0.0 111.263 178.42 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -85.18 -1.67 57.16 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.527 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.8 m -119.81 174.58 6.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-O 121.427 0.632 . . . . 0.0 110.947 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.3 m -138.03 139.95 39.86 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 4.5 m -132.56 161.61 41.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 35.3 mm -106.36 131.84 55.06 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.504 ' CG1' HD11 ' A' ' 51' ' ' LEU . 49.7 t -105.06 117.22 50.34 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.198 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -119.71 121.27 38.84 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 121.569 0.7 . . . . 0.0 110.849 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -81.68 118.64 22.99 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.211 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.449 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.59 154.03 66.42 Favored Pre-proline 0 C--O 1.211 -0.946 0 N-CA-C 110.359 -0.237 . . . . 0.0 110.359 -176.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 129.71 28.69 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 C-N-CA 122.364 2.043 . . . . 0.0 111.733 178.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.533 ' HA ' ' HB2' ' A' ' 50' ' ' ASP . 2.8 pt -44.05 -39.24 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -133.49 20.33 4.17 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 119.365 -1.397 . . . . 0.0 112.885 178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.4 -61.84 4.66 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -176.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.9 t -86.26 117.07 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.161 0 N-CA-C 105.685 -1.968 . . . . 0.0 105.685 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt . . . . . 0 C--N 1.286 -2.178 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.917 177.493 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.613 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -66.28 110.11 1.71 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.24 1.96 . . . . 0.0 111.109 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.3 mt -85.09 100.94 12.04 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 147.79 110.21 0.58 Allowed Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.0 t -74.37 -28.27 61.04 Favored 'General case' 0 C--O 1.249 1.05 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 24.9 ptm -71.67 108.67 5.13 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.792 -1.549 . . . . 0.0 108.239 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 23' ' ' THR . 50.9 m -107.63 150.77 26.5 Favored 'General case' 0 C--N 1.253 -3.591 0 CA-C-N 113.64 -1.618 . . . . 0.0 108.104 -173.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.6 p -140.43 136.82 33.44 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.093 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.588 HG23 ' CE1' ' A' ' 24' ' ' PHE . 68.9 t -105.84 128.48 60.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -78.32 113.96 16.79 Favored 'General case' 0 CA--C 1.484 -1.558 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.604 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.3 p90 -135.08 138.38 43.77 Favored 'General case' 0 C--N 1.277 -2.545 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -125.04 136.59 53.83 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 118.615 -1.234 . . . . 0.0 109.788 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.46 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -88.59 170.67 10.65 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 179.432 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.8 p -66.13 -15.68 63.32 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.303 0.573 . . . . 0.0 112.051 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.5 p -94.57 -11.85 28.65 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 123.215 0.606 . . . . 0.0 111.763 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 0.9 OUTLIER -102.73 133.25 48.09 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 120.9 0.381 . . . . 0.0 110.732 -175.171 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.19 -22.82 22.6 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -127.37 170.82 12.11 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -82.37 133.57 35.23 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.549 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 20.2 m-20 -83.98 175.88 9.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 171.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -143.09 116.07 8.84 Favored 'General case' 0 C--N 1.292 -1.912 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.146 -177.651 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -95.21 125.85 47.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.1 p -93.9 123.88 37.54 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-O 121.592 0.711 . . . . 0.0 112.783 -177.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.588 ' CE1' HG23 ' A' ' 9' ' ' VAL . 22.7 p90 -136.35 176.14 8.96 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -178.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.2 148.7 30.51 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.37 -113.15 3.6 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.785 176.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -148.5 -41.32 0.16 Allowed 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -137.33 155.36 49.51 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.95 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.5 tt -126.56 131.77 70.94 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.593 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.238 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 m -63.52 140.28 58.86 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 58.4 tp -55.65 -36.68 67.32 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.566 1.146 . . . . 0.0 112.443 -176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.724 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 18.7 t -54.13 -46.86 72.29 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 13.9 t70 -74.38 -37.82 63.33 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -175.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.4 tm? -58.39 -46.97 85.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.684 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -70.06 -39.88 75.4 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.983 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.724 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -65.11 -37.08 86.33 Favored 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.515 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 89.2 mt-30 -66.36 -45.37 80.39 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.09 -41.06 81.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.911 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.5 mtm -63.95 -37.27 86.79 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.425 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.52 -44.17 41.96 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 120.283 -0.96 . . . . 0.0 111.747 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 25.5 ttt180 -64.84 -49.41 70.68 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' OE2' ' HG2' ' A' ' 41' ' ' ARG . 23.1 mm-40 -92.65 12.99 21.34 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.669 0.271 . . . . 0.0 111.72 -173.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 57.34 47.44 16.64 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.292 1.037 . . . . 0.0 112.166 176.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD2' HD13 ' A' ' 51' ' ' LEU . 9.4 mp -81.81 160.89 23.42 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.975 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -96.96 112.43 24.19 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.62 -13.38 58.03 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.06 -13.71 22.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.727 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.48 ' O ' HG12 ' A' ' 82' ' ' ILE . 14.5 t70 -113.84 -38.52 4.22 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 121.768 0.794 . . . . 0.0 110.73 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.01 174.63 7.47 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.66 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.531 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 23.5 t0 -126.43 166.41 17.25 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 178.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 53' ' ' ILE . 28.5 tp -121.85 113.72 20.04 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -111.59 123.61 50.59 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.976 -175.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.587 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.0 mp -113.41 127.36 70.76 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -173.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.448 ' OG1' ' HG2' ' A' ' 61' ' ' GLU . 29.8 m -122.22 134.57 54.7 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.559 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.1 t-20 -62.71 140.16 58.71 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -21.37 41.42 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.232 0.539 . . . . 0.0 111.68 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -101.14 -48.27 4.47 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.712 -176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.5 p -90.74 -20.04 22.86 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.355 0.597 . . . . 0.0 109.855 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.3 mmmt 64.14 24.1 13.35 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.585 1.154 . . . . 0.0 110.928 -177.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -80.52 125.01 29.43 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.448 ' HG2' ' OG1' ' A' ' 54' ' ' THR . 44.0 mt-10 -86.12 125.72 33.68 Favored 'General case' 0 N--CA 1.402 -2.839 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.78 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HB3' HD22 ' A' ' 31' ' ' LEU . 80.3 m-85 -89.48 94.74 9.99 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.014 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -88.7 -27.35 21.29 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.954 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.99 146.9 27.65 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.691 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.656 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -69.15 -14.33 62.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.6 -10.88 59.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.102 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.81 143.31 57.95 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.448 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.65 137.55 52.57 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 118.705 0.684 . . . . 0.0 110.762 -175.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.29 118.74 35.41 Favored Pre-proline 0 C--N 1.314 -0.958 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.006 176.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 80.4 Cg_endo -82.64 161.03 16.7 Favored 'Trans proline' 0 C--N 1.326 -0.651 0 C-N-CA 123.478 2.785 . . . . 0.0 113.66 176.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.505 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 40.2 pttt -70.05 -5.84 29.46 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.737 0.779 . . . . 0.0 111.203 175.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -87.65 -1.49 57.99 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.045 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -124.42 152.91 42.7 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.971 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.9 m -116.23 133.62 55.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.3 m -127.78 156.13 39.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.506 0.67 . . . . 0.0 112.406 -174.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -101.15 128.67 53.18 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 106.622 -1.621 . . . . 0.0 106.622 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.483 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.9 t -108.77 115.29 49.03 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -116.52 126.7 53.71 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.46 -174.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -89.82 111.53 22.58 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 pp -111.01 149.99 41.26 Favored Pre-proline 0 C--N 1.297 -1.711 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.8 138.56 13.37 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.724 1.616 . . . . 0.0 112.893 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.531 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 38.1 pt -81.81 -25.45 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 172.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 165.88 -71.78 0.18 Allowed Glycine 0 N--CA 1.408 -3.231 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 177.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.67 174.06 32.12 Favored Glycine 0 N--CA 1.421 -2.347 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.9 m -62.65 126.77 21.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-O 121.523 0.678 . . . . 0.0 112.038 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--N 1.3 -1.555 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 178.533 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.985 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -64.08 -31.81 64.85 Favored 'Trans proline' 0 C--O 1.239 0.551 0 C-N-CA 122.825 2.35 . . . . 0.0 112.298 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.33 162.5 13.14 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 96.0 147.79 23.18 Favored Glycine 0 N--CA 1.419 -2.436 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.434 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.9 m -89.38 102.21 14.89 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 87.5 mtp -99.57 -171.05 1.99 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.045 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.593 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 38.6 m -117.03 112.53 21.07 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 64.3 m -139.5 135.45 33.51 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.389 -174.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 21' ' ' THR . 77.5 t -106.82 132.07 55.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -88.1 115.21 25.42 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 46.0 p90 -130.02 130.9 45.55 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 pttp -109.32 139.22 44.55 Favored 'General case' 0 C--N 1.3 -1.577 0 C-N-CA 116.733 -1.987 . . . . 0.0 107.355 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -84.01 165.9 18.21 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.7 m -69.77 -16.99 63.4 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.325 0.583 . . . . 0.0 110.925 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 p -90.59 -13.06 35.2 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 121.367 0.603 . . . . 0.0 110.274 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -105.45 147.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.447 0.642 . . . . 0.0 111.31 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.7 mp -96.89 -30.79 12.93 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -105.89 163.22 12.91 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.394 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -86.89 142.97 27.64 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.363 0.601 . . . . 0.0 111.789 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -108.53 177.37 4.81 Favored 'General case' 0 C--N 1.288 -2.104 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.494 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -143.67 128.05 17.86 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -174.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 1.9 m -95.79 128.61 46.83 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 172.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.423 HG22 ' SG ' ' A' ' 8' ' ' CYS . 21.8 p -94.96 122.41 37.58 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.593 ' O ' ' HB2' ' A' ' 7' ' ' SER . 21.0 p90 -140.49 171.31 14.32 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -177.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -114.06 122.24 46.27 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.51 -172.32 23.07 Favored Glycine 0 N--CA 1.43 -1.709 0 N-CA-C 108.979 -1.648 . . . . 0.0 108.979 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -96.44 -33.52 11.85 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.173 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.538 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -146.06 151.52 37.86 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.119 -177.515 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -120.29 129.49 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.413 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.968 -178.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -60.96 142.22 56.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.971 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.454 HD22 ' HB3' ' A' ' 62' ' ' TYR . 56.3 tp -55.23 -40.58 71.03 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 124.734 1.214 . . . . 0.0 111.389 -177.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 65' ' ' ASP . 36.0 t -54.14 -46.44 72.23 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.528 0.518 . . . . 0.0 109.808 178.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.1 t70 -74.9 -41.05 60.48 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.861 -176.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -60.53 -44.18 96.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.175 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 51.0 mtmt -65.37 -38.62 90.6 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.436 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 6.0 mptp? -61.63 -37.93 85.78 Favored 'General case' 0 C--O 1.243 0.75 0 O-C-N 123.012 0.195 . . . . 0.0 110.859 177.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 67.6 mm-40 -67.22 -50.39 60.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.14 -43.76 84.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.133 -176.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.9 mtm -63.97 -39.51 94.3 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 122.273 -0.267 . . . . 0.0 111.047 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -42.28 74.23 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.386 177.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.61 -46.46 75.79 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -92.07 2.34 56.63 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt 65.33 53.55 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 124.946 1.298 . . . . 0.0 111.051 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.81 158.26 18.2 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.203 177.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -93.91 100.78 12.88 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-O 122.153 0.978 . . . . 0.0 109.172 175.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.31 60.33 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.991 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.42 -12.25 32.69 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.043 0.449 . . . . 0.0 111.447 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -105.45 -39.76 6.03 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.203 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.11 177.14 7.52 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.733 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.442 ' HB3' HD11 ' A' ' 80' ' ' ILE . 3.3 t70 -127.51 171.17 11.84 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 -178.274 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 18.2 tp -118.41 125.46 50.02 Favored 'General case' 0 C--N 1.275 -2.667 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.605 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.8 tt0 -114.02 121.94 45.39 Favored 'General case' 0 C--N 1.29 -2.0 0 O-C-N 121.831 -0.543 . . . . 0.0 110.216 -175.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.425 HG13 HG22 ' A' ' 77' ' ' VAL . 2.0 mp -114.08 127.64 71.4 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.977 0 CA-C-O 120.969 0.414 . . . . 0.0 110.809 -175.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.9 m -111.21 144.61 40.09 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.538 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.0 t-20 -80.85 131.39 35.38 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.55 -11.07 58.7 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 120.963 0.411 . . . . 0.0 111.456 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -105.92 -47.92 3.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.006 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.6 p -89.68 -19.19 25.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt 71.85 14.55 5.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.456 1.502 . . . . 0.0 110.678 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -80.68 131.33 35.45 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -95.11 126.75 40.66 Favored 'General case' 0 N--CA 1.408 -2.53 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.49 ' CD1' ' HB1' ' A' ' 67' ' ' ALA . 32.6 m-85 -90.51 101.93 14.66 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -177.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.9 p -101.01 -22.22 14.81 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.161 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.03 147.61 26.74 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -76.32 -7.83 55.79 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.74 -10.91 58.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.49 ' HB1' ' CD1' ' A' ' 62' ' ' TYR . . . -62.2 141.46 58.18 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.12 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.538 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -117.53 138.42 51.91 Favored 'General case' 0 C--N 1.29 -2.018 0 O-C-N 121.908 -0.495 . . . . 0.0 111.437 -174.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.27 115.69 42.44 Favored Pre-proline 0 C--N 1.309 -1.162 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.441 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.51 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 54.7 Cg_endo -80.25 153.43 21.41 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.988 2.458 . . . . 0.0 113.592 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 16.1 ptmt -60.35 -20.27 58.79 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.852 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -75.31 -19.56 59.57 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.164 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.414 ' OG ' ' HG2' ' A' ' 70' ' ' PRO . 24.7 m -104.32 139.39 39.37 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-O 121.588 0.709 . . . . 0.0 112.455 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.3 m -97.89 129.38 44.83 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 171.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -123.95 164.39 22.11 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.5 mt -120.93 130.15 74.95 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 53' ' ' ILE . 23.1 t -102.27 124.39 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.772 -173.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -120.33 145.03 47.52 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.0 ttm105 -100.68 125.85 47.15 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.605 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -129.49 156.29 78.83 Favored Pre-proline 0 C--O 1.217 -0.639 0 C-N-CA 121.249 -0.18 . . . . 0.0 110.83 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -75.97 140.65 23.11 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.079 1.852 . . . . 0.0 110.318 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 17.6 pt -65.48 -45.6 92.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.964 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 52.92 44.02 61.45 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.697 -178.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.36 139.33 6.13 Favored Glycine 0 N--CA 1.426 -1.972 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -178.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.5 m -99.71 104.46 16.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 CA-C-O 122.183 0.992 . . . . 0.0 110.954 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.6 pttp . . . . . 0 C--N 1.291 -1.966 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.011 -178.775 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.312 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.28 -170.46 0.8 Allowed 'Trans proline' 0 C--O 1.246 0.894 0 C-N-CA 122.383 2.055 . . . . 0.0 110.407 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.3 tp -56.85 123.96 16.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 113.56 50.38 0.53 Allowed Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 108.458 -1.857 . . . . 0.0 108.458 -171.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.2 m -109.15 14.94 23.62 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp 64.25 -170.87 0.18 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.028 -1.442 . . . . 0.0 110.393 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.6 m -132.32 122.25 24.81 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.5 p -148.43 143.33 26.7 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.834 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.481 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.6 t -106.26 131.94 54.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -77.56 112.32 14.22 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 124.056 0.848 . . . . 0.0 108.749 174.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.637 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -132.31 141.47 48.98 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -120.54 142.46 49.31 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 117.77 -1.572 . . . . 0.0 108.473 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.555 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -84.5 157.38 21.32 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 176.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -55.58 -31.0 61.82 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.254 0.622 . . . . 0.0 112.601 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -122.43 16.63 10.51 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.123 0.487 . . . . 0.0 111.106 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 16.1 tptm -86.13 -29.03 23.61 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.6 tp 74.04 -52.78 0.69 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.102 1.761 . . . . 0.0 112.174 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -98.75 152.61 19.49 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.081 -178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -74.95 142.86 43.9 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.915 0.864 . . . . 0.0 112.274 -178.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -115.24 178.74 4.18 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -140.4 117.36 11.11 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 120.866 0.365 . . . . 0.0 110.289 -174.522 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 13.0 p -95.37 118.7 42.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.4 p -85.66 127.33 34.46 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.974 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 7' ' ' SER . 32.9 p90 -142.35 176.29 9.11 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -114.68 144.67 43.06 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.26 -179.14 19.8 Favored Glycine 0 C--N 1.306 -1.137 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -175.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -87.22 -33.36 19.35 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 118.03 0.915 . . . . 0.0 109.068 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.536 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -138.1 159.88 40.87 Favored 'General case' 0 CA--C 1.484 -1.576 0 CA-C-N 114.746 -1.116 . . . . 0.0 112.119 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.2 tt -128.28 128.53 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.098 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.536 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.6 m -62.66 147.03 50.65 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.256 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.73 -42.19 88.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 123.972 0.909 . . . . 0.0 112.697 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.586 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 33.7 t -56.5 -45.55 80.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.46 -45.78 82.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.909 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.36 -46.57 82.85 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.912 -176.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.8 mtmt -64.17 -41.18 97.24 Favored 'General case' 0 C--O 1.207 -1.139 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -62.94 -37.24 86.25 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -62.59 -50.62 70.54 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.025 0.441 . . . . 0.0 109.831 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.77 -47.8 68.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.87 -176.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.417 ' HG3' HD22 ' A' ' 51' ' ' LEU . 71.6 mtm -65.8 -33.59 76.21 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.43 35.71 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 119.211 -1.471 . . . . 0.0 111.16 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -59.63 -50.86 72.22 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.521 0.728 . . . . 0.0 111.931 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 7.7 mm-40 -92.72 0.22 57.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.266 0.555 . . . . 0.0 110.338 -174.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 60.75 70.93 0.59 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.69 1.196 . . . . 0.0 112.686 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.473 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.3 mp -103.97 144.2 31.84 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.526 -1.216 . . . . 0.0 108.899 175.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 7.0 ptpp? -92.9 103.49 15.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.972 0.892 . . . . 0.0 111.331 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.95 -16.48 62.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.43 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.04 1.75 51.88 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.308 0.575 . . . . 0.0 110.994 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.487 ' O ' HG12 ' A' ' 82' ' ' ILE . 26.0 t70 -122.16 -36.72 2.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.608 0.718 . . . . 0.0 109.955 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -135.44 153.61 51.72 Favored 'General case' 0 N--CA 1.42 -1.951 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.717 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.486 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 27.0 t0 -108.6 159.92 16.34 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.6 tp -107.68 107.95 18.98 Favored 'General case' 0 C--N 1.267 -2.989 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HB2' HG12 ' A' ' 80' ' ' ILE . 31.8 tt0 -103.43 108.96 20.42 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.908 0.861 . . . . 0.0 109.123 -173.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.484 HD12 HG22 ' A' ' 77' ' ' VAL . 25.3 mm -94.56 135.42 28.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.314 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 24.3 m -118.8 149.33 41.69 Favored 'General case' 0 C--N 1.281 -2.4 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.502 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.7 t-20 -72.49 139.69 47.79 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.45 -26.25 51.3 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.144 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -92.74 -58.15 2.44 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.449 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.9 p -87.94 -16.61 33.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.152 0.501 . . . . 0.0 110.67 -171.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 63.71 21.79 12.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.091 0.956 . . . . 0.0 111.489 -177.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -75.46 130.4 38.86 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.1 mt-10 -87.44 137.49 32.29 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-O 121.097 0.475 . . . . 0.0 110.665 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -103.77 103.0 12.84 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -106.39 -19.96 13.53 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.922 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -90.21 133.62 34.8 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.502 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.5 m-20 -66.96 -13.25 61.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 120.801 0.334 . . . . 0.0 111.881 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -85.43 -6.19 59.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.32 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.28 141.77 58.64 Favored 'General case' 0 C--O 1.208 -1.117 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.536 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.96 137.63 52.71 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -177.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.72 115.45 35.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.278 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -77.71 155.85 31.28 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.042 2.495 . . . . 0.0 113.254 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 53.5 pttt -69.71 -8.14 45.3 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.536 0.684 . . . . 0.0 111.447 178.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -81.56 -17.7 47.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.383 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.5 m -105.71 158.72 16.52 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.879 -177.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 m -119.62 136.86 54.21 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.637 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -130.9 166.24 29.09 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 CA-C-O 121.078 0.466 . . . . 0.0 111.102 -175.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.5 mt -120.03 130.57 74.11 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.484 HG22 HD12 ' A' ' 53' ' ' ILE . 57.6 t -102.01 122.47 54.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.005 -173.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -127.51 128.13 45.16 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 47.6 ttp180 -88.1 125.85 34.8 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.495 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -122.68 142.18 36.98 Favored Pre-proline 0 N--CA 1.439 -0.988 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -75.13 128.53 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.481 0 C-N-CA 122.261 1.974 . . . . 0.0 110.847 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ASP . 23.9 pt -72.1 -30.73 37.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.541 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.62 -20.73 61.21 Favored Glycine 0 N--CA 1.441 -1.02 0 C-N-CA 120.209 -0.996 . . . . 0.0 111.193 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.81 -55.29 3.19 Favored Glycine 0 N--CA 1.434 -1.461 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 48.1 t -94.19 95.52 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 mttp . . . . . 0 C--N 1.3 -1.555 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.199 -178.178 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.276 0 CA-C-O 119.163 -0.798 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.35 -50.39 12.17 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 123.614 2.876 . . . . 0.0 112.609 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.96 -47.39 9.01 Favored 'General case' 0 CA--C 1.485 -1.521 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.0 -100.47 0.22 Allowed Glycine 0 N--CA 1.398 -3.875 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.374 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 m 58.39 35.64 24.92 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 -174.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -62.98 154.04 31.81 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.183 -1.826 . . . . 0.0 113.035 -171.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.8 m -127.4 134.25 49.92 Favored 'General case' 0 N--CA 1.403 -2.795 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.909 -177.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 14.5 p -146.37 140.19 26.18 Favored 'General case' 0 N--CA 1.418 -2.043 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.513 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.537 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.9 t -107.74 124.66 63.98 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.256 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -73.62 105.35 4.91 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 124.203 0.939 . . . . 0.0 108.893 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -124.97 133.39 53.03 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -108.31 134.73 50.73 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 117.205 -1.798 . . . . 0.0 108.283 174.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 1.2 t80 -97.88 161.79 13.56 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.161 -2.162 . . . . 0.0 105.161 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 t -59.71 -26.29 65.5 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 t -87.86 -12.0 46.12 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.175 0.512 . . . . 0.0 110.833 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 2.8 mptp? -96.18 133.09 40.91 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 177.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.68 -22.76 25.89 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.3 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.505 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 18.7 m120 -120.42 168.62 11.12 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.572 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -76.5 144.67 39.64 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.644 0.735 . . . . 0.0 112.122 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -104.85 177.88 4.72 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -141.77 113.68 7.96 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 118.716 0.689 . . . . 0.0 112.006 -174.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.61 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.16 136.61 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.9 p -108.24 145.47 34.26 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -174.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.537 ' HE1' HG23 ' A' ' 9' ' ' VAL . 30.1 p90 -158.71 157.36 31.63 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.12 115.35 28.84 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 118.224 0.465 . . . . 0.0 109.78 175.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.23 175.6 14.97 Favored Glycine 0 C--N 1.284 -2.345 0 N-CA-C 108.205 -1.958 . . . . 0.0 108.205 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.0 tp -85.43 -32.86 22.1 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 118.409 1.105 . . . . 0.0 110.774 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -145.5 151.24 37.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -177.247 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.9 131.37 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.039 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.622 -177.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.1 m -61.84 148.05 44.55 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 123.122 0.569 . . . . 0.0 110.376 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 124.059 0.944 . . . . 0.0 111.394 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.63 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 49.5 t -55.59 -46.13 77.32 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -69.71 -44.33 70.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.261 0.553 . . . . 0.0 110.289 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.43 -45.82 89.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.09 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.0 mtmt -62.7 -42.96 99.91 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.922 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.3 mptp? -61.47 -35.44 77.64 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 120.753 0.311 . . . . 0.0 111.123 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -69.85 -42.71 73.19 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.455 ' O ' ' HB3' ' A' ' 41' ' ' ARG . 66.3 mt -74.34 -36.21 41.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.691 0.281 . . . . 0.0 111.444 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.505 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.5 mtt -62.45 -46.0 90.49 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.83 -38.67 93.16 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.258 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 25.8 tpt180 -54.62 -50.24 68.57 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.552 1.541 . . . . 0.0 110.925 178.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 67.1 mm-40 -100.58 6.29 44.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -176.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.407 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 63.96 36.23 10.21 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.591 0.756 . . . . 0.0 111.999 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.435 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.3 mp -66.74 154.05 41.72 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.599 0.714 . . . . 0.0 112.382 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 19.9 ptmt -98.44 106.88 19.22 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.652 173.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.83 -6.06 55.06 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.231 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.96 -5.5 59.23 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.904 177.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.544 ' O ' HG12 ' A' ' 82' ' ' ILE . 17.9 t70 -128.88 -42.36 1.41 Allowed 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.511 0.672 . . . . 0.0 109.756 176.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.409 ' C ' HG23 ' A' ' 82' ' ' ILE . 71.5 m -120.62 157.58 29.23 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.513 ' HB2' HG22 ' A' ' 82' ' ' ILE . 41.6 t0 -113.46 169.34 9.03 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' HD11 ' A' ' 53' ' ' ILE . 15.7 tp -119.62 113.41 20.65 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 119.756 -0.778 . . . . 0.0 108.953 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.627 HE21 HG21 ' A' ' 80' ' ' ILE . 9.3 tt0 -106.53 120.5 42.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.049 -177.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.471 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.1 mm -106.5 135.68 43.96 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.7 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 23.4 m -117.28 151.06 37.73 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 175.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.596 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -78.03 145.71 35.75 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 175.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.29 -21.86 24.2 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.304 0.573 . . . . 0.0 110.861 -178.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -96.75 -48.87 5.31 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.579 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 35.9 p -93.77 -21.89 19.03 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.02 0.438 . . . . 0.0 110.353 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 68.3 19.36 9.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.037 1.335 . . . . 0.0 112.139 -175.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.51 125.8 27.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.9 mt-10 -87.73 127.48 35.31 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.224 0.535 . . . . 0.0 110.785 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -93.04 100.95 13.28 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.0 p -99.19 -35.86 9.85 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.646 -176.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -85.88 135.71 33.59 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -66.8 -12.45 58.96 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -90.91 -1.42 57.84 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.867 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.92 148.29 51.77 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.62 137.63 53.14 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 118.393 0.542 . . . . 0.0 110.689 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -115.87 118.45 38.58 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.968 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.41 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 83.3 Cg_endo -83.62 157.5 14.18 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.097 2.532 . . . . 0.0 112.982 176.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.74 3.26 5.3 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 122.495 1.141 . . . . 0.0 110.78 176.462 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -87.68 -18.55 29.28 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.05 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.7 m -116.31 151.59 35.56 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.355 0.598 . . . . 0.0 111.74 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.2 t -105.96 137.63 43.53 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 176.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -128.46 159.65 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-O 121.648 0.737 . . . . 0.0 112.781 -177.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.3 mm -109.42 126.29 66.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.452 HG22 HD12 ' A' ' 53' ' ' ILE . 61.4 t -101.4 123.26 54.38 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.283 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 ttp-105 -122.94 124.48 43.29 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.225 0.536 . . . . 0.0 109.856 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -83.59 120.33 25.83 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.627 HG21 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -124.66 153.84 70.06 Favored Pre-proline 0 C--O 1.201 -1.471 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.86 138.76 38.25 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.07 1.847 . . . . 0.0 111.947 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 48' ' ' ASP . 11.3 pt -68.12 -31.73 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-O 121.558 0.694 . . . . 0.0 110.478 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 143.7 29.6 0.11 Allowed Glycine 0 N--CA 1.428 -1.835 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.404 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.78 165.12 13.83 Favored Glycine 0 N--CA 1.426 -1.985 0 N-CA-C 108.968 -1.653 . . . . 0.0 108.968 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.8 p -76.57 113.1 15.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 CA-C-O 121.855 0.836 . . . . 0.0 109.505 178.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.2 mttm . . . . . 0 C--N 1.297 -1.685 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.854 -176.913 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.359 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.42 134.97 23.54 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 122.305 2.003 . . . . 0.0 112.483 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.3 mt -72.83 -41.22 65.09 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.93 171.57 37.03 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.1 t 57.47 80.45 0.17 Allowed 'General case' 0 C--O 1.242 0.676 0 C-N-CA 123.552 0.741 . . . . 0.0 111.174 179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.7 mtp -69.63 133.53 47.68 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' THR . 70.8 m -79.39 115.45 19.04 Favored 'General case' 0 N--CA 1.397 -3.099 0 CA-C-O 121.673 0.749 . . . . 0.0 111.891 -171.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.2 p -140.38 132.79 28.45 Favored 'General case' 0 N--CA 1.399 -3.023 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.04 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.595 HG23 ' HE1' ' A' ' 24' ' ' PHE . 43.5 t -107.11 127.96 62.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 62.7 m-70 -79.66 105.64 11.1 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 174.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.2 p90 -118.0 142.3 47.52 Favored 'General case' 0 C--N 1.28 -2.426 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -123.65 124.27 42.39 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 118.77 -1.172 . . . . 0.0 110.199 174.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -80.32 157.89 26.26 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 177.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 m -56.89 -37.68 71.72 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.042 0.448 . . . . 0.0 110.229 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 p -88.06 -8.59 55.32 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.43 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 31.5 tptt -83.37 -37.73 22.93 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 tt 73.65 -51.78 0.7 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 125.726 1.61 . . . . 0.0 109.571 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -100.18 170.01 8.75 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -88.2 155.66 19.64 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.22 0.533 . . . . 0.0 111.095 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.6 t70 -128.33 178.53 6.2 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -133.78 117.88 17.4 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 119.366 0.984 . . . . 0.0 112.258 -173.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.4 p -99.9 123.14 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.7 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 7' ' ' SER . 36.1 p -92.03 143.06 26.85 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.968 -177.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HE1' HG23 ' A' ' 9' ' ' VAL . 41.4 p90 -154.6 172.23 18.18 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.681 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.59 133.0 43.56 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.229 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.85 178.59 21.58 Favored Glycine 0 C--N 1.292 -1.915 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.03 -33.96 19.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -137.78 164.1 29.74 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.011 -179.15 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.0 tt -134.1 131.08 55.44 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.548 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m -63.58 143.16 58.06 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.9 tp -54.54 -40.08 68.32 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.27 1.428 . . . . 0.0 113.351 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.533 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.5 t -55.96 -45.89 78.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.719 0.295 . . . . 0.0 110.539 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.88 -41.73 70.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.26 -46.13 85.05 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.978 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.7 mtmt -61.73 -42.56 99.12 Favored 'General case' 0 C--O 1.206 -1.199 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.45 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.75 -35.11 77.15 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.27 0.356 . . . . 0.0 111.849 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -70.64 -45.68 64.72 Favored 'General case' 0 C--O 1.21 -1.009 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.109 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.4 -38.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.846 0.355 . . . . 0.0 111.348 -178.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.5 mtt -63.7 -38.99 93.2 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.6 -31.8 60.24 Favored Glycine 0 C--O 1.219 -0.833 0 N-CA-C 111.771 -0.531 . . . . 0.0 111.771 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.507 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 24.9 tpt180 -64.59 -51.36 63.15 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 124.818 1.247 . . . . 0.0 110.865 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -94.63 -17.95 21.82 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 80.4 70.14 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 125.811 1.645 . . . . 0.0 111.825 -176.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -97.55 165.93 11.75 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 114.803 -1.089 . . . . 0.0 111.793 176.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -107.19 101.79 11.16 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.235 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.77 -13.98 60.66 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.925 -173.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.52 2.38 56.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.721 0.772 . . . . 0.0 110.374 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -119.21 -36.26 3.42 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.742 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.3 p -139.22 162.48 34.89 Favored 'General case' 0 C--N 1.297 -1.695 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.806 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.457 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 40.4 t0 -114.6 166.58 11.58 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HG ' HD11 ' A' ' 53' ' ' ILE . 16.1 tp -117.33 105.54 12.28 Favored 'General case' 0 C--N 1.263 -3.153 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -174.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.439 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.6 tp60 -90.93 123.42 34.41 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 -175.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.427 HD11 ' HG ' ' A' ' 51' ' ' LEU . 27.8 mm -110.84 135.22 50.62 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.571 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.0 m -123.19 140.73 52.72 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.9 t-20 -71.52 139.68 49.62 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -29.66 55.88 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.631 0.729 . . . . 0.0 110.687 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -94.32 -49.64 5.62 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.127 -173.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.4 p -93.18 -18.23 22.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.291 0.567 . . . . 0.0 109.475 -175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 42.0 mmtm 65.15 22.55 12.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.603 1.161 . . . . 0.0 112.242 -177.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -78.06 129.26 35.02 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -83.73 136.89 34.0 Favored 'General case' 0 N--CA 1.412 -2.373 0 CA-C-O 121.336 0.588 . . . . 0.0 109.595 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.44 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 89.7 m-85 -96.13 98.73 10.57 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 3.2 p -91.8 -40.98 10.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -175.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -91.87 147.45 22.96 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 13.5 m-20 -66.06 -16.03 63.58 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.887 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -88.96 -1.33 58.05 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.201 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.44 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -66.42 145.4 55.72 Favored 'General case' 0 C--O 1.209 -1.076 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.06 137.73 52.71 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 119.928 -0.709 . . . . 0.0 112.696 -172.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.13 117.97 40.75 Favored Pre-proline 0 C--N 1.312 -1.024 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.87 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 64.4 Cg_endo -81.83 154.48 17.58 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.083 2.522 . . . . 0.0 112.827 174.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.557 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.17 -10.72 56.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -87.76 -2.05 58.36 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.319 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 55.2 m -106.92 140.0 40.42 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.302 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 m -100.0 131.67 45.82 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 172.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 55' ' ' ASN . 27.0 m -125.88 159.86 33.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -176.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 mm -105.07 135.34 43.5 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 45.5 t -111.73 117.66 55.67 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-O 120.973 0.416 . . . . 0.0 110.085 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -119.38 122.9 42.84 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.407 0.683 . . . . 0.0 109.993 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -77.97 121.6 24.41 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.439 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.37 146.72 45.55 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.867 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.03 135.47 23.15 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.344 2.029 . . . . 0.0 111.043 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.457 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.8 pt -80.57 -27.69 11.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.1 -79.65 1.69 Allowed Glycine 0 N--CA 1.419 -2.455 0 N-CA-C 108.781 -1.727 . . . . 0.0 108.781 -173.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.22 41.29 0.45 Allowed Glycine 0 N--CA 1.418 -2.553 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.027 178.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 38.5 t -78.63 86.7 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -177.55 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.989 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.11 125.53 18.38 Favored 'Trans proline' 0 C--O 1.244 0.798 0 C-N-CA 122.737 2.291 . . . . 0.0 110.811 176.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.6 mt -101.42 142.97 32.02 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.15 -38.94 24.77 Favored Glycine 0 N--CA 1.436 -1.342 0 N-CA-C 111.277 -0.729 . . . . 0.0 111.277 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m 62.54 27.41 16.22 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.279 1.031 . . . . 0.0 110.733 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 92.5 mmm 55.94 98.67 0.02 OUTLIER 'General case' 0 CA--C 1.494 -1.174 0 C-N-CA 124.709 1.204 . . . . 0.0 111.475 -171.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.586 ' O ' ' HA ' ' A' ' 23' ' ' THR . 3.3 m -63.17 120.24 11.12 Favored 'General case' 0 C--N 1.281 -2.37 0 CA-C-N 112.863 -1.971 . . . . 0.0 108.021 -175.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.3 p -138.11 134.17 34.31 Favored 'General case' 0 N--CA 1.419 -2.007 0 C-N-CA 119.542 -0.863 . . . . 0.0 111.855 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' CE1' ' A' ' 24' ' ' PHE . 74.5 t -106.67 125.59 62.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 175.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -77.82 119.75 21.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.658 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 43.1 p90 -133.98 138.55 45.51 Favored 'General case' 0 C--N 1.286 -2.176 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -118.46 146.12 44.73 Favored 'General case' 0 N--CA 1.426 -1.649 0 C-N-CA 118.433 -1.307 . . . . 0.0 107.678 173.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -92.87 169.4 10.49 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -63.7 -16.68 61.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.901 0.857 . . . . 0.0 110.708 174.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.0 m -138.15 107.85 6.25 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 171.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -177.81 -39.23 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.0 tp 76.71 -52.53 0.58 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.905 1.682 . . . . 0.0 111.136 -178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -102.01 172.65 6.79 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -94.99 143.38 26.52 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-O 121.24 0.543 . . . . 0.0 109.672 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -104.6 177.76 4.75 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 175.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.13 116.29 9.44 Favored 'General case' 0 C--N 1.275 -2.642 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -173.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 15.0 p -95.16 116.94 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.782 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.586 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.2 p -89.42 124.36 34.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.587 0.708 . . . . 0.0 112.201 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.461 ' CE1' HG23 ' A' ' 9' ' ' VAL . 31.6 p90 -132.92 177.17 7.86 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -176.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -113.8 136.1 53.23 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.95 174.48 17.17 Favored Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -82.12 -35.58 28.38 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.503 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -135.08 159.24 42.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -179.753 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.4 tt -127.4 126.14 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.572 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.0 m -59.74 141.36 55.35 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.957 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.459 HD11 ' CG1' ' A' ' 53' ' ' ILE . 56.8 tp -55.24 -40.91 71.43 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 123.973 0.909 . . . . 0.0 112.045 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.734 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 9.3 t -56.3 -46.66 79.71 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.8 t70 -68.05 -43.92 77.57 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 -177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.22 -46.61 89.71 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.883 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 44.2 mtmt -67.13 -40.48 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.707 0.289 . . . . 0.0 110.645 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.3 mptt -65.03 -34.09 77.61 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.093 178.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.6 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 83.2 mm-40 -62.13 -49.95 73.84 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.353 0.596 . . . . 0.0 109.495 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.3 mt -67.76 -47.85 78.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.627 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.1 mtm -63.33 -37.24 86.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.853 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.43 61.89 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.154 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -72.39 -49.55 33.01 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 122.628 0.371 . . . . 0.0 111.548 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 44.2 mt-10 -93.45 -1.74 55.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 18.9 mmtp 71.75 45.02 0.45 Allowed 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.411 1.085 . . . . 0.0 111.225 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.7 mp -73.34 162.99 28.71 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.942 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.46 100.28 12.86 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.133 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.07 -14.73 58.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.887 -173.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.68 -4.39 23.83 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.878 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -103.1 -42.55 5.74 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.972 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.4 m -133.65 166.17 23.24 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.7 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -108.13 162.14 14.33 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.524 HD11 ' CG1' ' A' ' 77' ' ' VAL . 33.1 tp -107.44 125.05 50.75 Favored 'General case' 0 C--N 1.251 -3.674 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.603 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.2 tt0 -110.67 128.93 55.91 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 -178.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.7 mm -113.31 133.62 58.62 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -176.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 22.8 m -116.71 153.39 32.46 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 176.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -83.86 146.51 28.05 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.08 -12.45 28.48 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.267 0.556 . . . . 0.0 111.187 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -103.76 -39.64 6.58 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.096 -176.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -100.04 -25.11 14.42 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.8 mmmm 68.84 24.93 6.33 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.099 1.359 . . . . 0.0 111.131 -176.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -90.24 135.51 33.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.731 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 18.4 mp0 -78.81 141.53 37.67 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 121.043 0.449 . . . . 0.0 110.959 175.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -103.21 99.4 9.25 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 173.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 p -82.22 -31.18 30.42 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' HD23 ' A' ' 31' ' ' LEU . 2.2 m-20 -105.87 139.42 40.46 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.608 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -63.19 -7.25 5.51 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.066 0.946 . . . . 0.0 111.454 178.179 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -90.63 -0.16 57.59 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.368 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.04 152.05 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.503 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.76 137.35 53.42 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 118.21 0.459 . . . . 0.0 110.36 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -116.34 117.3 38.75 Favored Pre-proline 0 C--N 1.304 -1.386 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.652 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.7 Cg_endo -79.77 159.7 24.72 Favored 'Trans proline' 0 C--N 1.323 -0.779 0 C-N-CA 122.936 2.424 . . . . 0.0 112.683 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.1 pttt -70.59 1.01 5.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.486 0.66 . . . . 0.0 111.327 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -87.81 -11.26 48.49 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.8 m -122.21 149.35 43.79 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 121.389 0.614 . . . . 0.0 112.56 -172.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 m -103.43 133.28 48.75 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 19.2 m -126.25 169.78 17.18 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 CA-C-O 120.924 0.392 . . . . 0.0 111.026 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mt -123.95 136.11 61.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 123.704 0.802 . . . . 0.0 109.012 -177.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.524 ' CG1' HD11 ' A' ' 51' ' ' LEU . 26.3 t -106.23 128.58 60.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.472 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -136.73 133.4 36.04 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -89.62 132.42 35.13 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.603 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -131.44 152.65 80.85 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 118.215 0.461 . . . . 0.0 110.318 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.77 128.8 17.5 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 121.795 1.663 . . . . 0.0 110.875 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.4 pt -50.69 -44.53 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 CA-C-O 121.073 0.463 . . . . 0.0 111.846 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -127.53 -51.98 0.14 Allowed Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 163.89 -75.3 0.17 Allowed Glycine 0 CA--C 1.472 -2.625 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 28.3 m -72.74 135.34 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 172.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.8 pttp . . . . . 0 C--N 1.284 -2.277 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -171.769 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.45 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -86.35 168.19 8.85 Favored 'Trans proline' 0 C--O 1.248 1.011 0 C-N-CA 122.962 2.442 . . . . 0.0 112.123 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.4 tp -68.62 -32.66 72.69 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.74 38.41 2.94 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.49 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.0 t -67.19 -45.07 78.01 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.213 1.006 . . . . 0.0 109.573 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 95.7 mmm -91.91 -179.82 5.4 Favored 'General case' 0 C--N 1.273 -2.725 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.807 178.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HA ' ' A' ' 23' ' ' THR . 41.9 m -96.22 127.06 41.89 Favored 'General case' 0 C--N 1.275 -2.665 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.797 -175.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.608 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.1 p -148.53 135.19 19.78 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.357 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.584 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.3 t -107.06 134.43 48.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -84.0 109.68 17.83 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -127.82 138.97 52.9 Favored 'General case' 0 C--N 1.277 -2.555 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -121.03 137.52 54.61 Favored 'General case' 0 C--N 1.281 -2.398 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.4 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.5 t80 -90.42 156.77 17.98 Favored 'General case' 0 C--N 1.283 -2.29 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.6 m -56.92 -29.19 62.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.899 0.381 . . . . 0.0 111.007 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.6 m -83.76 -10.96 57.74 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.311 0.644 . . . . 0.0 111.813 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -101.19 156.98 17.11 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 122.107 -0.37 . . . . 0.0 110.873 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.9 mt -97.56 -43.24 7.31 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.736 0.779 . . . . 0.0 108.949 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -114.54 167.64 10.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.394 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -76.12 149.1 37.44 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.948 0.88 . . . . 0.0 112.779 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -112.16 177.11 4.75 Favored 'General case' 0 C--N 1.28 -2.441 0 N-CA-C 105.126 -2.175 . . . . 0.0 105.126 174.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -140.18 113.53 8.49 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 118.612 0.642 . . . . 0.0 110.354 -174.035 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 12.2 p -96.3 124.07 48.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.402 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.527 ' HA ' ' O ' ' A' ' 7' ' ' SER . 13.3 p -87.3 140.07 29.92 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.648 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.584 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.0 p90 -148.08 167.36 25.18 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 120.987 0.423 . . . . 0.0 110.736 -178.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -101.63 116.15 32.1 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.611 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.42 177.07 15.46 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 110.435 -1.066 . . . . 0.0 110.435 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.3 tp -77.52 -30.98 53.14 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 122.021 0.915 . . . . 0.0 109.529 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.61 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.76 158.72 43.46 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.533 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 tt -124.53 128.1 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.103 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 m -62.1 142.3 57.65 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.944 175.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 58.2 tp -54.41 -39.87 67.71 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 125.301 1.441 . . . . 0.0 112.262 -176.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.557 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -55.83 -46.19 78.18 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 123.24 0.337 . . . . 0.0 110.602 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.1 t70 -73.34 -39.08 65.49 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -175.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.76 -46.19 89.19 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.05 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 53.4 mtmt -66.32 -39.76 89.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.0 mptp? -61.71 -40.35 94.72 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.275 178.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 64.6 mt-30 -66.9 -50.32 62.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.445 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.72 -43.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.631 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.55 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 71.1 mtm -64.27 -45.07 89.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.74 -178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.38 -33.89 61.09 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.965 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 41' ' ' ARG . 35.3 ttt180 -75.09 -46.75 32.56 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 32.2 mm-40 -94.24 13.13 24.36 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp 68.16 34.04 4.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.518 1.127 . . . . 0.0 111.873 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 10.5 mp -74.62 174.19 9.39 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.172 0.987 . . . . 0.0 112.819 -178.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.613 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 13.2 ptpt -109.82 108.28 18.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.618 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.37 -20.71 31.52 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -175.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -107.04 -15.13 14.76 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.947 0.403 . . . . 0.0 111.343 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.613 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 14.4 t70 -92.56 -27.66 17.23 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -176.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.672 ' SG ' ' HA ' ' A' ' 86' ' ' LYS . 73.4 m -147.94 167.51 24.66 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -110.87 169.5 8.72 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.472 HD11 HG12 ' A' ' 77' ' ' VAL . 31.2 tp -127.52 119.78 26.8 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -175.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HB2' HG12 ' A' ' 80' ' ' ILE . 39.4 tt0 -121.63 136.98 54.92 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -115.39 135.62 54.79 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.904 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -176.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 m -121.51 146.03 47.35 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.541 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -74.64 137.22 42.1 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.77 43.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.364 0.602 . . . . 0.0 111.205 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -100.06 -52.84 3.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.929 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.3 p -92.23 -16.59 25.97 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.6 mmmm 68.41 17.13 9.19 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.749 1.219 . . . . 0.0 111.463 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -81.4 132.42 35.32 Favored 'General case' 0 N--CA 1.433 -1.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -83.85 146.71 27.95 Favored 'General case' 0 N--CA 1.415 -2.195 0 CA-C-O 121.577 0.703 . . . . 0.0 110.416 178.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 79.7 m-85 -107.22 103.83 13.3 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -100.38 -36.99 9.04 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -88.61 140.01 29.89 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.546 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 2.0 m-20 -68.61 -10.79 58.17 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -88.83 -4.45 58.49 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.035 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.424 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -63.73 142.89 58.24 Favored 'General case' 0 C--O 1.208 -1.095 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.61 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -117.14 137.79 52.08 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.586 -173.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.62 117.87 37.54 Favored Pre-proline 0 C--N 1.306 -1.323 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 91.2 Cg_endo -81.3 160.22 20.09 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 123.233 2.622 . . . . 0.0 114.063 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -67.96 -9.19 43.37 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.889 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -87.91 -1.57 58.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.423 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.9 m -121.01 157.34 30.2 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 121.406 0.622 . . . . 0.0 112.233 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 m -115.06 130.83 57.03 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 174.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.4 m -127.26 160.22 36.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.46 0.647 . . . . 0.0 112.694 -175.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.4 mm -104.0 123.86 58.01 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 51' ' ' LEU . 40.6 t -104.43 120.12 54.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -127.13 130.51 49.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.239 -172.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -83.52 120.93 26.54 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.63 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -117.59 156.62 49.22 Favored Pre-proline 0 C--N 1.313 -0.985 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.735 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 26.0 Cg_endo -64.32 131.09 28.87 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.231 1.954 . . . . 0.0 112.798 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 pt -64.0 -24.57 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-O 121.635 0.731 . . . . 0.0 109.616 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -162.05 -58.78 0.02 OUTLIER Glycine 0 N--CA 1.425 -2.042 0 N-CA-C 107.375 -2.29 . . . . 0.0 107.375 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.402 ' H ' ' H ' ' A' ' 85' ' ' VAL . . . -140.62 -28.08 0.2 Allowed Glycine 0 N--CA 1.431 -1.682 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 81' ' ' PRO . 7.2 t -69.43 115.78 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-O 121.301 0.572 . . . . 0.0 109.807 178.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.672 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 2.4 pptp? . . . . . 0 C--N 1.289 -2.035 0 C-N-CA 125.821 1.649 . . . . 0.0 106.735 175.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.605 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -82.57 41.86 1.19 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.364 2.709 . . . . 0.0 112.676 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pp -130.39 160.11 35.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.716 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.99 56.17 4.82 Favored Glycine 0 CA--C 1.517 0.203 0 CA-C-O 121.345 0.414 . . . . 0.0 113.59 -176.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.3 m -153.81 92.65 1.58 Allowed 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.8 ptp -163.06 179.71 7.32 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.669 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 50.3 m -108.61 114.7 28.72 Favored 'General case' 0 N--CA 1.422 -1.845 0 C-N-CA 119.728 -0.789 . . . . 0.0 110.301 176.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.0 p -132.95 135.72 45.69 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.85 -177.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG23 ' HE1' ' A' ' 24' ' ' PHE . 40.8 t -110.29 126.61 67.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -82.4 111.34 18.36 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.635 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.2 p90 -127.36 139.91 52.54 Favored 'General case' 0 C--N 1.28 -2.44 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -123.1 139.28 54.24 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.001 -1.48 . . . . 0.0 107.876 174.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -78.7 171.23 15.45 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -57.77 -37.54 73.85 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 123.28 0.632 . . . . 0.0 111.867 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.7 m -102.22 9.78 39.79 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-O 121.067 0.46 . . . . 0.0 111.918 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -92.71 135.19 34.32 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.2 mt -96.79 -24.12 16.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.428 0.632 . . . . 0.0 109.796 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -107.13 165.18 11.55 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -92.63 138.59 31.37 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.289 0.566 . . . . 0.0 110.219 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 173.24 7.79 Favored 'General case' 0 C--N 1.281 -2.37 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 175.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.51 128.95 30.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -111.86 138.89 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.222 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 176.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -116.7 143.84 45.15 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.1 p90 -153.7 176.81 11.68 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -125.81 130.56 51.65 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.403 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.34 -114.63 1.19 Allowed Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -140.9 -45.75 0.39 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.593 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -141.5 158.45 43.83 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -177.36 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -125.43 129.78 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.289 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -63.86 149.52 46.85 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 122.881 0.472 . . . . 0.0 110.471 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 43.2 tp -57.61 -44.75 85.7 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.544 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 50.4 t -56.64 -45.51 81.53 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.953 177.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.96 -42.31 94.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.416 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -62.67 -47.47 83.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.267 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.6 mtmt -67.21 -41.82 85.13 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.275 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -61.7 -35.18 77.3 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -69.1 -49.15 59.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 0.0 110.546 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.2 mt -69.56 -44.09 79.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.311 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.461 ' HG2' HD22 ' A' ' 44' ' ' LEU . 72.3 mtm -62.94 -37.34 86.66 Favored 'General case' 0 CA--C 1.51 -0.591 0 O-C-N 122.23 -0.294 . . . . 0.0 111.34 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.94 -41.58 87.52 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -66.89 -38.07 85.59 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 123.079 0.551 . . . . 0.0 112.119 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.96 11.87 37.83 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.967 0.413 . . . . 0.0 111.158 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? 59.34 38.36 23.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.513 172.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.461 HD22 ' HG2' ' A' ' 39' ' ' MET . 9.2 mp -73.13 152.91 40.98 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -83.85 100.48 10.99 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.36 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.41 -8.3 59.41 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.195 -173.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 6.69 42.59 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.155 0.503 . . . . 0.0 109.993 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.571 ' O ' HG12 ' A' ' 82' ' ' ILE . 13.2 t70 -130.23 -40.84 1.28 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.403 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.78 172.54 9.23 Favored 'General case' 0 N--CA 1.418 -2.059 0 CA-C-O 121.552 0.691 . . . . 0.0 111.241 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -126.3 166.74 16.57 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.9 tp -111.32 118.29 35.48 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.503 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.4 tp60 -104.51 126.13 51.31 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.422 HD12 HG22 ' A' ' 77' ' ' VAL . 30.3 mm -108.92 135.23 48.44 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -176.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.7 m -127.17 136.68 52.41 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.531 ' HA ' HG12 ' A' ' 75' ' ' VAL . 12.3 t-20 -64.97 135.09 55.25 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 117.892 0.314 . . . . 0.0 110.3 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.9 -23.26 58.34 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.228 0.537 . . . . 0.0 110.786 -178.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -94.98 -55.81 2.96 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.874 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -92.72 -15.78 26.26 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.891 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.95 21.23 12.54 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.537 0.735 . . . . 0.0 112.458 -174.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -71.96 117.86 14.1 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -81.52 138.91 35.4 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.07 96.98 7.59 Favored 'General case' 0 C--N 1.274 -2.712 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.2 p -94.59 -20.02 19.98 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.742 -175.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.64 129.46 45.78 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.574 -174.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -71.22 -7.59 47.86 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.709 0.686 . . . . 0.0 112.191 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -93.07 2.15 56.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.27 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.31 147.64 49.41 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 175.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.593 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.54 138.35 51.96 Favored 'General case' 0 C--N 1.28 -2.428 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.685 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -113.96 114.33 46.47 Favored Pre-proline 0 C--N 1.307 -1.279 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.858 175.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.518 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.3 Cg_endo -77.75 161.28 30.68 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.097 2.532 . . . . 0.0 112.806 175.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.669 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 19.9 pttm -66.92 -8.86 32.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.789 0.804 . . . . 0.0 111.219 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.61 -3.22 58.98 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.497 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.2 m -114.72 125.48 53.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 120.903 0.382 . . . . 0.0 111.404 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.0 m -90.26 123.58 34.16 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 23.6 m -123.54 155.12 29.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.431 0.634 . . . . 0.0 112.598 -175.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.26 132.23 48.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.495 ' CG1' HD11 ' A' ' 51' ' ' LEU . 70.5 t -105.93 125.46 61.43 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.577 -176.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -131.42 145.24 51.71 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 ttp85 -99.96 126.29 46.1 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 122.051 -0.406 . . . . 0.0 109.987 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.66 155.61 66.0 Favored Pre-proline 0 C--N 1.314 -0.976 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -178.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.28 131.33 15.06 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.316 2.01 . . . . 0.0 111.94 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 48' ' ' ASP . 12.4 pt -62.19 -41.97 93.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.511 0.196 . . . . 0.0 111.323 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 178.67 29.41 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.255 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -99.84 -64.62 0.82 Allowed Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 44.8 t -77.22 98.13 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.5 pttp . . . . . 0 C--N 1.299 -1.629 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -176.081 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.789 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.63 161.88 39.54 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 122.352 2.035 . . . . 0.0 111.538 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.3 mt -78.43 69.06 4.56 Favored 'General case' 0 C--O 1.249 1.032 0 CA-C-O 121.693 0.758 . . . . 0.0 111.056 -177.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.78 179.55 17.79 Favored Glycine 0 N--CA 1.425 -2.043 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.954 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t 66.09 15.33 10.04 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 124.622 1.169 . . . . 0.0 112.126 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 75.3 mtp -98.99 174.35 6.39 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.631 -177.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.5 m -86.78 111.59 20.87 Favored 'General case' 0 N--CA 1.409 -2.482 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 18.3 p -124.07 135.42 53.55 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.437 -175.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.0 t -107.93 124.77 64.34 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.42 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 80.2 m-70 -78.04 110.59 13.12 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.518 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 31.0 p90 -128.47 141.37 51.41 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -177.151 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HE3' HD12 ' A' ' 76' ' ' ILE . 18.6 pttp -117.11 130.94 56.97 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.341 -1.344 . . . . 0.0 107.894 172.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.9 t80 -85.03 163.44 18.85 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.526 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 11.5 m -56.9 -24.99 56.09 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 123.398 0.679 . . . . 0.0 111.515 175.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.5 m -94.9 -8.58 36.72 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.537 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -112.22 124.46 52.5 Favored 'General case' 0 CA--C 1.506 -0.728 0 O-C-N 121.869 -0.519 . . . . 0.0 110.348 -176.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mp -88.92 -4.87 58.33 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.509 0.671 . . . . 0.0 110.43 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -122.22 167.43 13.22 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -91.02 143.7 26.43 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.591 0.71 . . . . 0.0 112.321 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.6 t70 -111.83 177.88 4.5 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -140.21 117.45 11.29 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 118.21 0.459 . . . . 0.0 110.951 -174.435 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.6 142.07 14.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.8 p -116.29 133.26 56.21 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -174.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.532 ' HE1' HG23 ' A' ' 9' ' ' VAL . 28.2 p90 -143.12 177.03 8.67 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.602 1.161 . . . . 0.0 107.927 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -120.62 128.35 52.94 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.01 -114.03 1.04 Allowed Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.509 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -145.02 -42.45 0.23 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.527 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.08 153.36 42.1 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.4 tt -121.53 132.42 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.852 -178.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.44 ' HB2' ' OD1' ' A' ' 33' ' ' ASP . 37.5 m -64.75 146.52 54.68 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.03 176.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 50.6 tp -57.58 -43.34 84.51 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 124.528 1.131 . . . . 0.0 113.257 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.604 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 37.4 t -56.88 -45.83 82.26 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB2' ' A' ' 30' ' ' SER . 9.0 m-20 -63.38 -47.46 81.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.663 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.56 -47.47 84.13 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.521 1.128 . . . . 0.0 110.708 -176.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.7 mtmt -69.35 -43.48 73.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.952 -178.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.604 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.9 mptp? -61.85 -39.38 91.65 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 90.8 mt-30 -64.99 -50.57 65.81 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.7 mt -63.91 -47.54 90.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.884 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.95 -33.61 76.45 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.268 -178.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.66 -43.23 36.88 Favored Glycine 0 C--N 1.312 -0.797 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.268 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -59.52 -42.46 92.29 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 125.093 1.357 . . . . 0.0 111.838 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.429 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 33.6 mt-10 -104.05 8.92 36.63 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.043 -175.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.72 64.23 1.35 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.277 175.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.445 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 10.4 mp -99.73 -176.36 3.24 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.896 177.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 18.5 ptpt -107.47 100.62 10.03 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.88 0.848 . . . . 0.0 110.423 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.56 -18.33 38.7 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.719 -176.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.63 9.21 35.73 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.908 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.581 ' O ' HG12 ' A' ' 82' ' ' ILE . 23.8 t70 -133.36 -47.2 0.83 Allowed 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.762 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.9 m -112.63 176.95 4.8 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.892 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' HB2' HG22 ' A' ' 82' ' ' ILE . 37.2 t70 -124.09 163.08 22.21 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.3 tp -118.5 108.96 15.64 Favored 'General case' 0 N--CA 1.397 -3.104 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.3 tp-100 -91.39 120.81 32.57 Favored 'General case' 0 C--N 1.284 -2.255 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.454 HD11 ' HG ' ' A' ' 51' ' ' LEU . 35.2 mm -110.8 127.87 67.58 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.038 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -174.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 m -122.32 140.02 53.14 Favored 'General case' 0 C--N 1.268 -2.946 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.5 t-20 -65.37 131.83 47.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.87 -30.77 70.22 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.284 0.564 . . . . 0.0 110.746 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -91.48 -58.28 2.49 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.161 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.7 p -85.66 -14.94 43.99 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.038 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm 65.25 20.54 11.92 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.045 0.938 . . . . 0.0 111.685 -177.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.82 119.75 14.52 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.957 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -85.39 138.25 32.4 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-O 121.309 0.576 . . . . 0.0 109.92 177.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -100.61 90.42 4.26 Favored 'General case' 0 C--N 1.278 -2.504 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -82.48 -39.61 22.24 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.073 -175.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.538 ' HB3' ' OD1' ' A' ' 66' ' ' ASN . 6.8 m-20 -85.53 138.73 32.0 Favored 'General case' 0 CA--C 1.482 -1.638 0 CA-C-N 116.717 -0.219 . . . . 0.0 110.873 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.7 m-20 -66.57 -12.37 57.5 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.267 0.556 . . . . 0.0 111.239 -177.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.538 ' OD1' ' HB3' ' A' ' 64' ' ' ASP . 2.5 p-10 -92.87 1.01 57.51 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.43 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.86 151.64 46.32 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -118.71 138.02 52.93 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 118.137 0.426 . . . . 0.0 111.384 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.92 115.93 43.11 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.927 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 48.6 Cg_endo -75.67 153.61 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.867 2.378 . . . . 0.0 113.472 175.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HA ' HG22 ' A' ' 9' ' ' VAL . 18.0 pttp -63.67 -18.22 63.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.561 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -85.53 -4.93 59.31 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.655 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 43.5 m -116.88 139.29 50.8 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 120.906 0.384 . . . . 0.0 111.188 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 t -96.53 135.67 38.1 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -128.82 157.0 41.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 CA-C-O 121.251 0.548 . . . . 0.0 111.693 -177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 ' HE3' ' A' ' 12' ' ' LYS . 31.3 mm -102.04 132.69 47.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 11' ' ' TYR . 54.4 t -110.33 107.23 22.38 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.144 0 CA-C-O 121.442 0.639 . . . . 0.0 110.145 -175.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.526 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 12.0 tpt180 -110.34 123.7 50.33 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.199 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -81.66 122.62 27.86 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 176.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.662 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -125.81 156.59 71.04 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 120.477 0.179 . . . . 0.0 110.779 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.86 135.94 24.35 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 122.378 2.052 . . . . 0.0 111.11 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 48' ' ' ASP . 12.5 pt -62.13 -27.94 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.48 -69.79 0.3 Allowed Glycine 0 N--CA 1.423 -2.174 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.7 -92.51 0.09 OUTLIER Glycine 0 N--CA 1.421 -2.32 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 46.5 t -118.1 108.66 24.97 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 122.817 -0.225 . . . . 0.0 110.567 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? . . . . . 0 C--N 1.308 -1.227 0 C-N-CA 123.653 0.781 . . . . 0.0 109.744 175.954 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.493 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -76.54 47.84 2.22 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 123.966 3.11 . . . . 0.0 111.007 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.6 mt -98.86 80.75 2.54 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -176.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.94 -61.66 4.74 Favored Glycine 0 N--CA 1.46 0.284 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 -174.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.5 t -165.87 -62.03 0.03 OUTLIER 'General case' 0 N--CA 1.422 -1.847 0 N-CA-C 104.67 -2.344 . . . . 0.0 104.67 173.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp -148.75 136.85 20.92 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 112.957 -1.929 . . . . 0.0 106.015 175.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.605 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.1 m -76.73 120.83 22.44 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.9 p -137.93 140.45 40.3 Favored 'General case' 0 N--CA 1.419 -2.0 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.694 -176.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.416 HG23 ' CE1' ' A' ' 24' ' ' PHE . 77.3 t -106.78 124.69 62.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -79.78 114.61 18.84 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 175.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.0 p90 -130.36 141.16 50.58 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -130.56 136.83 49.3 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.57 173.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -86.08 165.67 16.45 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -175.754 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -58.51 -31.61 68.06 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.845 0.831 . . . . 0.0 108.957 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 m -84.32 -13.65 51.83 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 114.9 -1.045 . . . . 0.0 112.049 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' HD2' ' OE1' ' A' ' 42' ' ' GLU . 54.6 mtpt -116.08 126.46 53.78 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 121.885 -0.509 . . . . 0.0 111.252 -173.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.45 -41.01 48.93 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.086 -0.507 . . . . 0.0 112.063 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -104.86 159.56 15.7 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.031 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -77.29 136.96 38.53 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 121.341 0.591 . . . . 0.0 111.982 -177.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.407 ' HB3' ' CE1' ' A' ' 11' ' ' TYR . 6.1 t70 -100.24 172.83 6.92 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.1 p -138.29 122.53 18.14 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -94.37 113.63 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 7' ' ' SER . 6.1 p -88.14 111.18 21.31 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.301 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.9 p90 -128.17 154.8 45.39 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -96.23 101.58 13.25 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.681 0.753 . . . . 0.0 109.675 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 157.49 -174.32 34.94 Favored Glycine 0 C--N 1.287 -2.162 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.64 -42.53 7.21 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.19 150.74 47.05 Favored 'General case' 0 CA--C 1.484 -1.596 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.75 179.788 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -120.65 129.39 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.4 0 CA-C-N 115.025 -0.988 . . . . 0.0 111.299 -177.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.8 m -56.83 141.62 43.91 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.609 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 64' ' ' ASP . 57.7 tp -56.12 -41.87 75.97 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -176.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.561 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 43.4 t -58.34 -45.93 87.22 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.512 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 2.9 m-20 -66.49 -44.52 82.38 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.534 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -59.12 -46.35 88.57 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 124.302 1.041 . . . . 0.0 110.016 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.3 mtmt -64.18 -42.27 96.75 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.655 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.47 -38.63 87.94 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 12.6 mm100 -62.11 -47.97 82.26 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.317 0.579 . . . . 0.0 109.56 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.8 mt -68.72 -42.78 83.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.325 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.3 mtt -61.39 -40.82 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.22 0.208 . . . . 0.0 111.065 -178.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.25 -35.78 60.24 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.544 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.48 ' HD2' ' OH ' ' A' ' 11' ' ' TYR . 31.5 ttm180 -73.12 -44.55 60.07 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.833 0.349 . . . . 0.0 111.864 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.488 ' OE1' ' HD2' ' A' ' 16' ' ' LYS . 58.6 mm-40 -91.56 9.05 33.71 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.601 -176.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . 0.34 0.0 OUTLIER 45.55 66.52 0.9 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.004 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -93.81 145.27 24.72 Favored 'General case' 0 CA--C 1.491 -1.306 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.596 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 8.0 ptpp? -88.87 101.56 14.17 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.186 173.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.26 -13.79 59.87 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.019 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.21 8.56 23.45 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.62 0.724 . . . . 0.0 109.985 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.484 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 15.0 t70 -130.57 -45.19 1.08 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.563 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.564 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 13.3 p -132.72 167.86 19.37 Favored 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.236 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -123.01 170.99 9.59 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 13.9 tp -118.25 127.17 53.48 Favored 'General case' 0 C--N 1.265 -3.103 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.551 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.6 tp60 -116.31 121.1 40.99 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.408 HD11 ' HG ' ' A' ' 51' ' ' LEU . 34.5 mm -106.73 135.57 44.7 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.7 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -173.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.8 m -122.72 148.02 45.8 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.4 t-20 -75.16 140.79 43.59 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.27 37.37 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.969 0.414 . . . . 0.0 111.278 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -95.65 -47.3 6.27 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.855 -176.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -90.79 -21.45 21.51 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.164 0.507 . . . . 0.0 109.778 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.9 mmmt 66.74 26.7 9.46 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.475 1.11 . . . . 0.0 109.914 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -91.86 136.18 33.35 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -79.86 147.56 31.69 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.801 0.81 . . . . 0.0 111.382 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -103.9 95.88 6.31 Favored 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.6 p -80.44 -47.38 14.44 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 114.942 -1.026 . . . . 0.0 113.541 -172.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.431 ' O ' HD23 ' A' ' 31' ' ' LEU . 3.1 t70 -94.65 145.94 24.49 Favored 'General case' 0 CA--C 1.487 -1.455 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.397 -175.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.444 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 8.8 p-10 -69.72 -4.35 19.35 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -88.96 -7.11 56.64 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.971 175.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.49 150.41 48.9 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.78 138.13 52.89 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.598 -0.689 . . . . 0.0 111.609 -174.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -115.3 115.13 42.75 Favored Pre-proline 0 C--N 1.319 -0.732 0 C-N-CA 120.059 -0.657 . . . . 0.0 110.415 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 94.9 Cg_endo -80.48 153.89 20.93 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 C-N-CA 123.154 2.569 . . . . 0.0 113.19 176.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.572 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.4 pttt -59.24 -25.01 63.67 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.68 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -76.57 -5.56 48.21 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -116.13 133.88 55.54 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.408 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.8 m -91.48 137.0 32.71 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.4 m -128.0 154.14 38.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 CA-C-O 121.481 0.658 . . . . 0.0 111.87 -177.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.92 133.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.438 ' CG1' HD11 ' A' ' 51' ' ' LEU . 48.2 t -106.27 109.96 29.78 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-O 121.275 0.56 . . . . 0.0 110.326 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -108.57 132.95 53.35 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.564 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 34.7 ttp85 -95.68 129.77 42.78 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -126.75 156.43 73.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.54 144.44 35.95 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.158 1.905 . . . . 0.0 111.978 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 48' ' ' ASP . 13.2 pt -82.42 -29.25 9.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-O 121.419 0.628 . . . . 0.0 109.44 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 131.76 -61.59 0.66 Allowed Glycine 0 N--CA 1.417 -2.588 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 -175.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.11 -97.6 0.59 Allowed Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.637 177.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 4.9 p -85.88 101.59 10.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.909 0.862 . . . . 0.0 110.024 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp . . . . . 0 C--N 1.302 -1.468 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.332 179.743 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.689 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.67 117.18 4.4 Favored 'Trans proline' 0 C--O 1.241 0.661 0 C-N-CA 122.716 2.277 . . . . 0.0 111.18 177.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -86.83 168.63 13.29 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.59 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.13 0.65 20.82 Favored Glycine 0 C--N 1.292 -1.877 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -175.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 m -95.42 0.88 53.88 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 121.115 0.483 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 70.8 mtp -82.57 111.2 18.35 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.562 ' O ' ' HA ' ' A' ' 23' ' ' THR . 30.4 m -75.67 119.59 19.9 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.216 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.4 p -139.73 135.6 33.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.517 -177.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 21' ' ' THR . 78.9 t -106.9 125.12 62.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -76.91 108.94 10.31 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 44.5 p90 -127.22 135.63 50.91 Favored 'General case' 0 C--N 1.28 -2.418 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -115.8 136.08 53.4 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.05 160.84 16.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.448 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 16.1 m -58.32 -30.32 66.6 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.53 0.681 . . . . 0.0 110.058 174.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.1 m -86.04 1.61 49.64 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.607 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 138.43 54.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.015 0.912 . . . . 0.0 111.878 177.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -85.96 -27.1 25.12 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -110.2 172.05 7.09 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.611 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -92.11 139.59 30.48 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.224 0.535 . . . . 0.0 112.038 -176.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.13 175.37 5.5 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 173.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.9 p -137.42 131.3 31.78 Favored 'General case' 0 CA--C 1.48 -1.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 7.9 p -109.63 125.32 66.79 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 7' ' ' SER . 4.2 p -90.95 140.99 29.31 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.691 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.504 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.3 p90 -150.57 174.14 13.31 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -107.02 140.81 39.23 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.54 -175.02 18.55 Favored Glycine 0 C--N 1.298 -1.565 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 tt -90.06 -40.68 12.14 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.548 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -133.45 155.26 49.86 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.969 -1.014 . . . . 0.0 112.15 -178.273 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.3 tt -121.62 126.6 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.522 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.431 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 13.2 m -60.31 146.88 42.43 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.505 177.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 62' ' ' TYR . 47.5 tp -58.91 -38.12 78.18 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 123.751 0.821 . . . . 0.0 111.399 -177.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.696 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.8 t -55.81 -46.9 77.94 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 175.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 22.2 m-20 -68.61 -41.91 78.87 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.352 -176.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.16 -46.67 70.12 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.035 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.6 mtmt -64.41 -42.86 95.82 Favored 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 121.307 -0.157 . . . . 0.0 111.365 -178.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.44 -36.82 81.45 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.418 0.449 . . . . 0.0 111.037 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 11.8 mm-40 -71.18 -44.37 65.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.334 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.5 mt -66.87 -40.42 85.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.508 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 59.9 mtt -60.36 -40.01 89.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.523 0.201 . . . . 0.0 110.511 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.8 -39.55 54.86 Favored Glycine 0 N--CA 1.438 -1.231 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.941 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -68.76 -49.55 57.78 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -82.37 -14.15 55.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.018 -173.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.7 mmtm 75.37 65.63 0.07 Allowed 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 125.85 1.66 . . . . 0.0 110.528 -178.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.75 152.64 19.46 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.696 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -104.82 102.13 11.7 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.907 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.37 -7.72 51.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.442 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -9.14 43.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.082 0.467 . . . . 0.0 110.545 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.415 ' O ' HG12 ' A' ' 82' ' ' ILE . 12.5 t70 -112.1 -42.53 3.73 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.105 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.8 m -129.86 171.67 12.48 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.03 -176.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.432 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 7.5 t70 -125.45 170.56 11.28 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.446 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.0 tp -120.9 115.78 23.89 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -173.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.514 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.6 tt0 -114.46 112.89 23.72 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.333 0.587 . . . . 0.0 110.277 -175.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.446 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.8 mp -99.01 135.27 34.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.793 -175.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -124.39 134.92 52.98 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 123.091 0.556 . . . . 0.0 109.513 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.516 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.2 t-20 -61.41 135.34 57.65 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.422 0.289 . . . . 0.0 110.277 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.41 -25.81 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.975 0.417 . . . . 0.0 111.442 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -93.34 -52.38 4.55 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.917 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.1 p -95.11 -15.84 23.07 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 62.47 26.61 15.84 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.799 0.809 . . . . 0.0 112.13 -174.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -73.17 116.66 13.96 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.29 126.65 34.97 Favored 'General case' 0 N--CA 1.42 -1.968 0 CA-C-O 121.397 0.618 . . . . 0.0 110.592 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.427 ' HB3' HD22 ' A' ' 31' ' ' LEU . 61.5 m-85 -99.3 104.18 16.06 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-N 114.698 -1.137 . . . . 0.0 108.252 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.2 p -113.52 -2.37 13.89 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.745 0.783 . . . . 0.0 110.34 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -106.08 131.93 52.77 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -65.58 -12.6 54.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-O 121.311 0.576 . . . . 0.0 111.404 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -91.6 2.13 56.67 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.789 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.61 147.79 47.23 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 173.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.548 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.99 138.48 52.79 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.265 0.484 . . . . 0.0 110.979 -176.315 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.17 113.89 35.24 Favored Pre-proline 0 C--N 1.314 -0.965 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.218 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.473 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 69.2 Cg_endo -76.89 152.74 32.46 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.086 2.524 . . . . 0.0 113.379 176.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.9 pttt -59.29 -23.74 62.68 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -78.76 -17.18 56.21 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.792 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.9 m -100.03 139.87 35.07 Favored 'General case' 0 C--N 1.308 -1.201 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.358 -175.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -99.38 136.58 39.11 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.2 m -130.99 155.84 42.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 120.952 0.406 . . . . 0.0 110.66 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.18 130.82 55.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 53' ' ' ILE . 27.0 t -105.78 113.23 42.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.318 -175.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 37.6 ttm180 -106.31 143.6 34.2 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.957 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -105.28 117.07 33.07 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.514 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -114.5 154.23 46.58 Favored Pre-proline 0 C--N 1.301 -1.535 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.406 -175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.35 143.75 31.85 Favored 'Trans proline' 0 C--N 1.325 -0.692 0 C-N-CA 122.621 2.214 . . . . 0.0 111.367 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.432 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 14.5 pt -84.47 -16.27 10.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.37 0.605 . . . . 0.0 110.063 177.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.5 -73.46 0.28 Allowed Glycine 0 N--CA 1.419 -2.472 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 178.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -135.0 151.68 20.52 Favored Glycine 0 N--CA 1.402 -3.627 0 N-CA-C 107.902 -2.079 . . . . 0.0 107.902 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.48 125.85 18.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 124.641 0.848 . . . . 0.0 112.011 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 pttm . . . . . 0 C--N 1.301 -1.512 0 CA-C-N 114.629 -1.168 . . . . 0.0 109.115 179.665 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.676 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.28 122.23 9.47 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 122.471 2.114 . . . . 0.0 111.906 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.6 mt -79.69 92.11 5.35 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.175 0.988 . . . . 0.0 110.677 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.5 165.97 25.14 Favored Glycine 0 N--CA 1.414 -2.828 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 47.9 t 70.79 16.38 6.7 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 123.852 0.861 . . . . 0.0 111.741 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 47.8 mtm 60.2 -164.13 0.23 Allowed 'General case' 0 C--O 1.248 1.021 0 CA-C-O 121.816 0.817 . . . . 0.0 112.352 176.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 73.4 m -132.27 117.76 18.61 Favored 'General case' 0 N--CA 1.406 -2.637 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 34.4 m -133.1 134.86 44.83 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.069 -172.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.501 ' O ' ' HA ' ' A' ' 21' ' ' THR . 92.2 t -106.54 134.46 48.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.435 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 41.9 m-70 -84.22 123.06 29.71 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 123.775 0.672 . . . . 0.0 109.324 177.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.606 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 53.3 p90 -136.64 142.27 43.23 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.072 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.44 ' HE3' HD12 ' A' ' 76' ' ' ILE . 21.7 pttp -123.64 116.23 22.76 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 119.801 -0.759 . . . . 0.0 110.232 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.652 ' HA ' HG13 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -68.77 165.61 19.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.435 -1.257 . . . . 0.0 111.275 178.814 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.4 m -56.61 -37.1 70.2 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.967 176.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.3 t -106.84 19.78 19.98 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.056 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -99.64 138.4 36.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.69 -31.72 16.48 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.647 0.737 . . . . 0.0 109.708 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -129.94 177.14 7.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -83.34 146.83 28.28 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.062 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.4 t70 -115.2 178.66 4.21 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -136.57 121.74 19.11 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 118.734 0.697 . . . . 0.0 110.677 -172.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.1 p -95.87 134.68 32.51 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.408 HG22 ' SG ' ' A' ' 8' ' ' CYS . 5.3 p -102.66 126.51 49.78 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.146 0.498 . . . . 0.0 111.494 -175.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' A' ' 7' ' ' SER . 29.3 p90 -141.29 172.27 12.91 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -106.83 137.5 44.75 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.0 -167.05 12.36 Favored Glycine 0 N--CA 1.429 -1.82 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.401 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.2 tm? -98.03 -31.63 12.05 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.631 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.16 147.67 33.99 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -112.16 123.95 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.297 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.9 m -63.97 143.32 57.95 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.953 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 46.8 tp -54.84 -41.05 70.27 Favored 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 124.684 1.194 . . . . 0.0 112.533 -175.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.639 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 32.2 t -53.18 -45.9 68.74 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 123.219 0.325 . . . . 0.0 110.339 176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.7 -39.8 61.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.523 0.678 . . . . 0.0 110.02 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 3.0 tm? -58.77 -47.21 85.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.287 -177.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.3 mtmt -70.68 -44.76 66.36 Favored 'General case' 0 C--O 1.203 -1.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.218 -178.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.0 mptp? -61.29 -37.71 84.16 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -175.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -64.64 -45.19 87.84 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.459 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.5 mt -73.95 -41.48 53.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.029 -176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 88.8 mtp -62.25 -37.64 86.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.708 0.289 . . . . 0.0 110.576 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.46 -42.4 41.31 Favored Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.781 176.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -64.73 -47.65 77.48 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -89.09 11.16 19.24 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.488 -175.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? 55.06 62.09 2.66 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 123.94 0.896 . . . . 0.0 111.169 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -91.61 145.88 24.24 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.567 177.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.621 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -95.13 101.77 13.54 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.58 -8.55 55.78 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.964 -175.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -90.18 -1.73 57.97 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.932 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.619 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 16.6 t70 -129.08 -37.12 1.71 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.453 0.644 . . . . 0.0 110.474 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -128.78 166.12 19.62 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-O 121.814 0.816 . . . . 0.0 112.424 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.495 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 21.2 t0 -125.47 169.32 12.52 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 126.02 1.728 . . . . 0.0 106.687 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.5 tp -117.42 111.25 19.06 Favored 'General case' 0 N--CA 1.404 -2.749 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HB2' HG12 ' A' ' 80' ' ' ILE . 62.1 tt0 -109.34 111.23 22.67 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.593 0.711 . . . . 0.0 109.853 -178.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' HG23 ' A' ' 77' ' ' VAL . 18.7 mm -92.95 136.18 25.68 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -123.37 143.19 50.27 Favored 'General case' 0 C--N 1.275 -2.654 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.433 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.0 t-20 -68.58 136.22 52.72 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 122.039 -0.413 . . . . 0.0 110.559 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -28.18 64.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -91.21 -58.18 2.54 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 121.186 0.517 . . . . 0.0 111.192 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 p -91.68 -17.44 25.47 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.195 -169.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.94 23.41 12.59 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.621 0.724 . . . . 0.0 112.549 -173.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.03 115.95 7.31 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -87.4 128.15 35.21 Favored 'General case' 0 N--CA 1.413 -2.293 0 CA-C-O 121.874 0.845 . . . . 0.0 110.174 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.2 93.53 8.73 Favored 'General case' 0 C--N 1.267 -2.995 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.062 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.8 p -98.36 -26.83 14.35 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.521 -1.218 . . . . 0.0 111.032 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -90.11 135.17 33.82 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 5.3 m-20 -68.81 -13.15 62.22 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.895 0.379 . . . . 0.0 111.801 -176.287 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -83.59 -9.19 59.08 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.155 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.12 136.25 57.67 Favored 'General case' 0 C--O 1.2 -1.513 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.631 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -117.82 137.65 52.61 Favored 'General case' 0 C--N 1.281 -2.391 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.221 -176.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -117.04 118.79 35.74 Favored Pre-proline 0 C--N 1.297 -1.693 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.729 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.3 Cg_endo -78.68 157.94 28.23 Favored 'Trans proline' 0 C--N 1.324 -0.718 0 C-N-CA 123.218 2.612 . . . . 0.0 113.404 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 49.6 pttt -70.19 -5.48 27.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.9 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -87.83 -4.27 58.88 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.759 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -122.43 157.94 30.82 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-O 120.973 0.416 . . . . 0.0 111.247 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m -118.86 137.76 53.21 Favored 'General case' 0 N--CA 1.422 -1.837 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 12.5 m -130.48 163.85 35.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.48 0.657 . . . . 0.0 111.697 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 ' HE3' ' A' ' 12' ' ' LYS . 13.9 mm -109.47 132.28 58.05 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.652 HG13 ' HA ' ' A' ' 13' ' ' PHE . 1.7 p -112.78 106.55 20.99 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 122.173 0.987 . . . . 0.0 111.207 -177.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -103.26 131.79 50.03 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.843 -174.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -90.51 117.57 29.3 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.505 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -116.6 151.56 47.26 Favored Pre-proline 0 C--N 1.308 -1.219 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -177.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -75.38 138.08 21.7 Favored 'Trans proline' 0 CA--C 1.549 1.248 0 C-N-CA 122.399 2.066 . . . . 0.0 112.362 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.495 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 12.7 pt -76.86 -44.17 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.326 0.584 . . . . 0.0 110.663 177.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -176.68 64.77 0.09 OUTLIER Glycine 0 N--CA 1.429 -1.787 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -155.74 147.83 17.15 Favored Glycine 0 N--CA 1.427 -1.932 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.7 m -87.16 112.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.334 0 CA-C-O 122.019 0.914 . . . . 0.0 111.766 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp . . . . . 0 C--N 1.3 -1.583 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 -178.469 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.421 0 N-CA-C 110.964 -0.855 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -62.12 -50.56 4.7 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.726 2.284 . . . . 0.0 110.857 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.4 tp -95.56 130.99 42.23 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.11 -42.22 98.15 Favored Glycine 0 C--O 1.226 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.558 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.5 m -72.04 -25.26 61.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.414 0.626 . . . . 0.0 110.42 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 87.2 mtp 63.96 173.73 0.18 Allowed 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.881 -175.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 71' ' ' LYS . 67.4 m -98.5 139.81 33.69 Favored 'General case' 0 N--CA 1.406 -2.657 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.239 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.1 p -144.73 135.14 24.37 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.084 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 71' ' ' LYS . 69.0 t -106.19 125.63 61.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -81.05 117.31 21.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 124.185 0.928 . . . . 0.0 108.874 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.621 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -133.26 140.55 47.55 Favored 'General case' 0 C--N 1.29 -1.995 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -124.26 140.92 52.5 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.62 165.68 18.8 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 m -56.55 -37.36 70.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.812 0.815 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.92 -3.87 55.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.573 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -110.52 143.34 41.01 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.9 tp -94.99 -37.73 11.0 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.573 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -99.97 158.02 16.12 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.391 -0.523 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.65 137.14 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 116.07 -0.514 . . . . 0.0 112.039 -176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -95.31 174.7 6.91 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 171.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -138.34 133.91 33.58 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -175.735 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.626 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.3 m -94.9 114.92 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 171.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -90.21 114.41 26.39 Favored 'General case' 0 N--CA 1.41 -2.46 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.152 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.434 ' CE1' HG23 ' A' ' 9' ' ' VAL . 5.5 p90 -135.83 165.39 25.73 Favored 'General case' 0 C--N 1.282 -2.327 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -177.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 6.01 32.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -174.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.48 -178.52 45.37 Favored Glycine 0 C--N 1.285 -2.25 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.577 177.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -89.78 -39.84 12.86 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.81 153.27 44.4 Favored 'General case' 0 CA--C 1.488 -1.437 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.045 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.0 tt -123.47 129.41 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.242 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.711 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -63.11 145.0 56.41 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.234 178.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.1 tp -54.99 -44.43 74.48 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.502 1.121 . . . . 0.0 112.981 -176.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.547 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.8 t -57.0 -45.58 82.9 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.148 0.499 . . . . 0.0 109.755 178.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 9.4 m-20 -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.146 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.77 95.96 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.04 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' HD23 ' A' ' 51' ' ' LEU . 54.7 mtmt -63.11 -41.55 99.38 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.252 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.61 -37.46 84.0 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.593 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.531 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -66.03 -50.23 64.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.083 0.468 . . . . 0.0 109.796 178.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.32 -43.36 91.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.632 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' HD22 ' A' ' 44' ' ' LEU . 71.7 mtm -66.02 -34.99 79.35 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.222 -0.191 . . . . 0.0 111.264 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.2 -39.98 51.12 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.496 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.416 HH22 ' HA ' ' A' ' 22' ' ' VAL . 23.7 ttm180 -67.47 -48.03 68.36 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 123.375 0.67 . . . . 0.0 112.151 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -91.49 2.11 56.66 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.316 -174.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.39 65.45 1.17 Allowed 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 124.444 1.098 . . . . 0.0 111.28 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 ' HG2' ' A' ' 39' ' ' MET . 10.8 mp -95.09 173.55 7.52 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.21 177.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HG3' ' SG ' ' A' ' 49' ' ' CYS . 16.8 ptpt -105.95 101.33 10.83 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.334 178.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.92 -13.29 59.89 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.384 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.58 4.68 45.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.997 0.427 . . . . 0.0 111.211 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -124.72 -40.53 2.19 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.391 0.615 . . . . 0.0 109.464 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.462 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 24.4 p -134.03 164.35 27.52 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.963 -178.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 82' ' ' ILE . 4.8 t0 -116.12 170.36 8.56 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.508 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.8 tp -115.43 123.71 49.3 Favored 'General case' 0 C--N 1.267 -3.019 0 CA-C-O 121.456 0.646 . . . . 0.0 109.283 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.552 ' HB2' HG12 ' A' ' 80' ' ' ILE . 5.1 tp-100 -103.4 123.94 47.78 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -177.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.412 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.1 mp -116.79 127.83 74.32 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.3 m -115.73 146.89 41.5 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.616 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -77.0 138.14 39.42 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.16 -21.42 46.48 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.683 0.754 . . . . 0.0 110.987 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -98.53 -56.23 2.52 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.927 -175.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.9 p -85.93 -19.65 30.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.553 0.692 . . . . 0.0 109.672 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.1 mmtp 63.45 21.07 12.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.914 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -77.89 129.51 35.46 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -93.62 127.82 39.49 Favored 'General case' 0 N--CA 1.416 -2.13 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -94.65 96.0 9.13 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -92.54 -21.14 20.28 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.025 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.461 ' HB3' ' OD1' ' A' ' 66' ' ' ASN . 12.8 m-20 -97.92 133.35 42.52 Favored 'General case' 0 CA--C 1.492 -1.275 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.475 ' HA ' HD23 ' A' ' 31' ' ' LEU . 3.1 p30 -73.39 -4.07 31.22 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -175.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.461 ' OD1' ' HB3' ' A' ' 64' ' ' ASP . 1.9 p-10 -85.35 -10.05 56.83 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.043 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.0 146.11 48.28 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.494 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.45 137.42 52.52 Favored 'General case' 0 C--N 1.289 -2.041 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.328 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.65 114.44 39.92 Favored Pre-proline 0 N--CA 1.435 -1.193 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.065 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.0 Cg_endo -78.89 156.67 27.16 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.166 2.577 . . . . 0.0 112.389 176.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.484 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.62 -7.48 33.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.925 0.869 . . . . 0.0 111.811 178.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -83.43 -11.88 57.04 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.39 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.9 m -112.58 152.25 29.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 120.888 0.375 . . . . 0.0 111.366 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.9 m -109.9 132.42 54.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 173.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.621 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.8 m -127.39 160.52 36.37 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -175.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.1 mm -112.29 132.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 HG13 ' A' ' 53' ' ' ILE . 25.0 t -109.24 129.71 63.51 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 CA-C-O 121.086 0.47 . . . . 0.0 110.789 -175.184 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 52' ' ' GLN . 29.4 ttm180 -126.61 152.26 46.88 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 125.225 1.41 . . . . 0.0 107.744 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.406 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 18.3 ttp180 -110.24 127.74 55.14 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.552 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.9 pp -132.59 161.58 62.43 Favored Pre-proline 0 C--O 1.21 -0.995 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.693 -175.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 33.2 Cg_endo -66.89 138.16 47.43 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 122.362 2.041 . . . . 0.0 112.12 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.437 HG23 ' C ' ' A' ' 49' ' ' CYS . 4.9 pt -61.3 -36.12 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 155.75 -67.13 0.3 Allowed Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 118.916 -1.611 . . . . 0.0 112.608 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.71 -42.12 7.92 Favored Glycine 0 CA--C 1.484 -1.89 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.45 90.56 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 86' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--N 1.292 -1.923 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.55 -178.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.554 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -79.67 54.6 5.27 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 123.65 2.9 . . . . 0.0 112.636 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -85.9 -5.84 59.17 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.57 30.49 5.29 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.582 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.6 t -149.62 24.03 0.88 Allowed 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 92.8 mmm 58.85 113.13 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 125.112 1.365 . . . . 0.0 112.931 -173.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 46.0 m -74.32 120.68 20.22 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.781 -176.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.642 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.6 p -147.78 142.41 26.6 Favored 'General case' 0 N--CA 1.422 -1.826 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.608 -175.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.8 t -107.18 136.55 41.87 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 178.182 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -83.32 109.54 17.36 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HG13 ' A' ' 22' ' ' VAL . 30.9 p90 -124.81 140.2 53.14 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 19' ' ' TYR . 63.8 pttt -125.68 123.2 38.38 Favored 'General case' 0 C--N 1.293 -1.872 0 C-N-CA 118.443 -1.303 . . . . 0.0 110.956 174.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 1.4 t80 -84.34 172.44 11.79 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.276 -176.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -64.13 -27.0 68.78 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.563 0.697 . . . . 0.0 109.232 170.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.7 m -82.57 -20.32 36.77 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.338 178.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.56 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 0.9 OUTLIER -111.65 101.46 9.85 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.672 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.76 -33.27 75.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.592 0.71 . . . . 0.0 110.646 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -114.36 169.19 9.22 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.633 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.445 ' HA ' ' HB3' ' A' ' 12' ' ' LYS . 98.5 m-85 -70.5 147.64 49.15 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -121.88 177.35 5.33 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 104.615 -2.365 . . . . 0.0 104.615 176.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.8 p -135.64 127.19 28.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -95.97 114.95 33.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.574 171.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 7' ' ' SER . 2.2 p -85.47 124.86 32.54 Favored 'General case' 0 N--CA 1.418 -2.045 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 7' ' ' SER . 38.5 p90 -142.28 176.68 8.8 Favored 'General case' 0 N--CA 1.434 -1.266 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -105.35 136.66 44.48 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.687 0.279 . . . . 0.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.95 -147.74 18.5 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.533 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.33 -39.8 4.32 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.75 157.86 45.3 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.432 -179.069 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -128.35 129.43 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.092 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.336 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.8 m -61.66 148.08 43.76 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.054 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.45 HD23 ' O ' ' A' ' 64' ' ' ASP . 51.7 tp -57.48 -41.53 80.87 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 124.186 0.994 . . . . 0.0 112.547 -176.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.678 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 48.0 t -55.61 -46.47 77.33 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 4.5 m-20 -69.88 -42.57 73.27 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.28 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.416 ' HG ' HD13 ' A' ' 69' ' ' ILE . 2.5 tm? -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 124.03 0.932 . . . . 0.0 110.361 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.9 mtmt -67.19 -38.3 85.15 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.566 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.678 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 1.6 mptm? -61.39 -36.57 80.64 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -64.4 -50.09 69.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 109.491 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.2 mt -73.01 -41.4 59.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.471 -174.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.4 mtt -59.94 -44.43 94.37 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 110.455 -0.202 . . . . 0.0 110.455 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.78 -33.7 71.29 Favored Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.727 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -71.92 -46.44 57.61 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -91.5 -1.5 57.51 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 120.858 0.361 . . . . 0.0 111.943 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm 66.93 66.96 0.42 Allowed 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 125.08 1.352 . . . . 0.0 110.363 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.81 170.01 9.61 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 17.9 ptpt -112.46 101.72 9.87 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.099 175.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.15 -6.6 59.54 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.364 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.94 -3.97 53.56 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.389 0.614 . . . . 0.0 110.171 177.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.431 ' C ' HG12 ' A' ' 82' ' ' ILE . 31.8 t70 -128.68 -30.3 2.31 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.58 0.705 . . . . 0.0 111.486 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.6 m -132.06 157.24 44.67 Favored 'General case' 0 N--CA 1.414 -2.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.38 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.572 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 37.5 t0 -120.01 162.19 19.66 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 53' ' ' ILE . 21.3 tp -108.92 108.13 18.77 Favored 'General case' 0 C--N 1.257 -3.429 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 -177.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -97.53 116.66 30.17 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-O 121.693 0.759 . . . . 0.0 109.249 -174.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.579 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.2 mm -105.26 130.52 56.36 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.757 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 m -125.02 141.59 52.03 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.59 128.9 38.51 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 122.594 0.357 . . . . 0.0 110.955 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.87 -29.51 65.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.24 0.543 . . . . 0.0 110.341 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -87.78 -58.11 2.69 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.862 -177.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.4 p -90.64 -14.28 32.66 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -171.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.17 21.69 12.98 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 123.344 0.658 . . . . 0.0 112.769 -172.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -74.74 121.87 22.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -92.31 119.54 31.99 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.571 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 87.7 m-85 -55.72 -65.29 0.62 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 123.645 0.778 . . . . 0.0 112.416 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.8 p 74.41 -36.8 0.34 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 127.802 2.441 . . . . 0.0 114.631 171.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' HD23 ' A' ' 31' ' ' LEU . 4.6 t70 -95.49 132.88 40.12 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -174.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 9.5 m-20 -65.27 -14.18 60.14 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.24 0.543 . . . . 0.0 111.703 -175.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -91.97 -1.97 56.99 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.48 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -72.49 145.1 47.76 Favored 'General case' 0 C--O 1.194 -1.836 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.53 138.32 51.98 Favored 'General case' 0 C--N 1.288 -2.104 0 CA-C-N 118.825 0.739 . . . . 0.0 111.399 -173.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.494 HG13 ' CZ ' ' A' ' 62' ' ' TYR . 3.2 mp -114.06 115.51 45.5 Favored Pre-proline 0 C--N 1.312 -1.042 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.506 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 92.3 Cg_endo -81.11 159.62 20.57 Favored 'Trans proline' 0 C--N 1.324 -0.761 0 C-N-CA 123.116 2.544 . . . . 0.0 113.479 175.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -73.35 4.83 4.18 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.966 176.049 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -87.54 -19.07 28.39 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.0 m -109.63 162.31 14.55 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.625 0.726 . . . . 0.0 112.765 -173.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.4 m -121.51 130.56 53.62 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.6 m -129.01 158.79 41.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.4 mm -99.69 129.17 50.68 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.562 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 59.9 t -109.74 111.48 36.33 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 CA-C-O 121.556 0.693 . . . . 0.0 109.46 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.0 ttp-105 -121.23 136.34 54.99 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.824 -174.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -93.08 128.35 38.95 Favored 'General case' 0 C--N 1.292 -1.899 0 O-C-N 121.954 -0.466 . . . . 0.0 110.216 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.481 HD11 ' HB3' ' A' ' 50' ' ' ASP . 2.5 pp -125.72 152.37 72.16 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 144.92 17.09 Favored 'Trans proline' 0 C--N 1.326 -0.649 0 C-N-CA 122.153 1.902 . . . . 0.0 111.117 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.572 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 29.3 pt -95.92 -39.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 C-N-CA 119.306 -0.957 . . . . 0.0 111.434 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.26 50.6 64.87 Favored Glycine 0 N--CA 1.442 -0.932 0 O-C-N 123.764 0.665 . . . . 0.0 111.54 -177.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -95.32 57.3 1.71 Allowed Glycine 0 N--CA 1.421 -2.319 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.2 t -78.6 90.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.387 0 CA-C-O 121.628 0.727 . . . . 0.0 109.929 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? . . . . . 0 C--N 1.282 -2.349 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.764 177.048 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.406 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.72 2.84 5.44 Favored 'Trans proline' 0 C--N 1.365 1.401 0 C-N-CA 123.531 2.821 . . . . 0.0 111.7 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -146.71 155.71 42.62 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -117.48 24.53 9.08 Favored Glycine 0 C--N 1.298 -1.534 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m -79.74 -2.91 45.19 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -175.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.9 mtp -119.24 152.05 37.34 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.522 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 49.5 m -134.65 133.17 39.8 Favored 'General case' 0 C--N 1.274 -2.68 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.411 -174.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.3 p -145.01 141.77 29.21 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.007 -178.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.515 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.2 t -107.02 129.9 59.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -80.61 110.85 16.49 Favored 'General case' 0 CA--C 1.491 -1.293 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 174.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.607 ' OH ' ' HG2' ' A' ' 41' ' ' ARG . 37.6 p90 -131.9 146.37 52.07 Favored 'General case' 0 C--N 1.28 -2.449 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -130.55 141.98 50.47 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.501 ' HZ ' HD21 ' A' ' 44' ' ' LEU . 1.1 t80 -89.81 169.35 11.34 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -177.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.2 m -56.93 -37.01 70.89 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.999 0.428 . . . . 0.0 111.297 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.7 m -90.99 4.02 53.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 25.9 mtpp -117.62 125.93 51.62 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.0 tt -83.26 -42.0 17.7 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.2 157.81 20.53 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -88.44 146.78 25.03 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 120.964 0.411 . . . . 0.0 110.698 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -112.06 174.76 5.73 Favored 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 p -139.37 115.71 10.5 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.144 0.497 . . . . 0.0 111.238 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.8 p -95.86 120.85 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.082 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 177.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.0 p -87.95 140.24 29.7 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.515 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.8 p90 -151.94 170.89 18.75 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -178.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -102.45 138.29 39.57 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.09 -173.91 17.06 Favored Glycine 0 N--CA 1.433 -1.509 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -88.66 -31.32 18.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.563 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -147.69 157.5 43.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -175.417 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 tt -121.73 128.5 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.247 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 16.3 m -63.79 147.09 52.65 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.223 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 64' ' ' ASP . 48.2 tp -57.81 -42.77 84.97 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 124.019 0.927 . . . . 0.0 112.419 -176.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -54.25 -45.17 72.33 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 19.2 m-20 -68.23 -49.69 59.01 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.463 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.2 -45.47 91.0 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.822 -1.081 . . . . 0.0 112.746 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' HD23 ' A' ' 51' ' ' LEU . 51.9 mtmt -63.05 -41.49 99.49 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.785 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.613 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.3 mptp? -61.58 -38.48 87.68 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 120.664 0.268 . . . . 0.0 110.373 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 15.4 mm100 -68.15 -50.15 56.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.69 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.8 mt -70.47 -39.07 75.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.7 mtm -64.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.967 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.36 -35.53 56.29 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.449 175.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 25.3 tpt180 -61.06 -51.17 70.31 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.197 0.999 . . . . 0.0 111.9 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.38 -1.12 54.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.86 0.362 . . . . 0.0 111.856 -176.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm 66.22 68.5 0.44 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 125.092 1.357 . . . . 0.0 110.48 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 ' HZ ' ' A' ' 13' ' ' PHE . 9.3 mp -95.52 158.22 15.55 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.793 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' HD3' ' HB2' ' A' ' 48' ' ' ASP . 8.1 ptpp? -85.1 101.04 12.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 170.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.72 -7.49 59.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -169.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.22 -12.85 17.7 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.705 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.473 ' HB2' ' HD3' ' A' ' 45' ' ' LYS . 4.0 m-20 -105.93 -16.5 14.62 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -175.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -148.03 170.29 18.07 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.461 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 28.4 t70 -120.94 164.9 16.0 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.475 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.5 tp -116.27 113.62 23.24 Favored 'General case' 0 N--CA 1.405 -2.724 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.539 ' HB2' HG12 ' A' ' 80' ' ' ILE . 33.8 tt0 -111.13 112.0 23.49 Favored 'General case' 0 C--N 1.281 -2.402 0 CA-C-O 121.781 0.801 . . . . 0.0 109.23 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.434 ' CD1' HG13 ' A' ' 77' ' ' VAL . 29.0 mm -90.53 135.77 25.68 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.48 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.663 -172.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 14.9 m -117.88 145.33 44.7 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.4 t-20 -74.73 141.98 44.42 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -84.97 -27.52 26.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.715 0.769 . . . . 0.0 110.62 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -85.03 -48.68 8.99 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.559 -175.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -98.1 -20.27 17.45 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.252 0.548 . . . . 0.0 110.076 -176.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 60.79 36.96 19.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.675 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -101.27 132.57 46.72 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 1.1 mp0 -81.69 148.11 29.16 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-O 121.878 0.847 . . . . 0.0 112.36 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -108.14 101.11 10.37 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 173.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.8 p -97.97 -27.26 14.33 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.286 0.565 . . . . 0.0 112.013 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' HD23 ' A' ' 31' ' ' LEU . 29.8 m-20 -91.01 128.46 36.84 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -177.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -66.96 -6.26 16.05 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -95.32 1.77 54.52 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.749 178.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.53 152.72 43.67 Favored 'General case' 0 C--O 1.207 -1.182 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 173.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.563 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.83 138.29 52.82 Favored 'General case' 0 C--N 1.289 -2.031 0 O-C-N 121.77 -0.581 . . . . 0.0 111.473 -178.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.49 117.16 38.55 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.223 175.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.476 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 74.0 Cg_endo -80.21 161.17 23.21 Favored 'Trans proline' 0 C--N 1.328 -0.523 0 C-N-CA 123.522 2.815 . . . . 0.0 114.064 177.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.522 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 47.4 pttt -67.62 -16.37 64.13 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.222 176.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -70.87 -25.64 62.89 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.796 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.8 m -98.32 159.68 14.79 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-O 121.639 0.733 . . . . 0.0 112.17 -173.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.9 m -124.01 127.87 48.54 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 173.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 55' ' ' ASN . 21.9 m -125.38 155.0 34.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 CA-C-O 121.593 0.711 . . . . 0.0 112.8 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.4 mm -104.16 127.84 58.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.475 ' CG1' HD11 ' A' ' 51' ' ' LEU . 60.0 t -99.46 111.58 29.46 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.519 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.359 -175.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -110.55 130.93 55.45 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.889 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -89.75 127.55 35.97 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.539 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.85 150.11 55.04 Favored Pre-proline 0 C--N 1.305 -1.364 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.085 -178.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.51 137.92 18.97 Favored 'Trans proline' 0 N--CA 1.448 -1.165 0 C-N-CA 122.063 1.842 . . . . 0.0 112.196 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.461 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 36.6 pt -89.7 -21.1 6.86 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 127.58 -56.31 0.73 Allowed Glycine 0 N--CA 1.424 -2.14 0 N-CA-C 108.288 -1.925 . . . . 0.0 108.288 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 142.05 52.3 0.04 OUTLIER Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.09 91.12 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.161 0 CA-C-O 121.733 0.777 . . . . 0.0 111.071 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.49 ' OXT' ' HD2' ' A' ' 86' ' ' LYS . 1.6 pptp? . . . . . 0 N--CA 1.408 -2.543 0 CA-C-N 113.822 -1.535 . . . . 0.0 107.293 175.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.306 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -66.35 -24.96 49.56 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.725 2.283 . . . . 0.0 112.647 -178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -100.83 12.41 37.63 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.99 55.66 1.84 Allowed Glycine 0 N--CA 1.43 -1.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.493 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 m 64.35 15.58 9.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.56 1.144 . . . . 0.0 112.998 176.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 41.3 mtm -109.84 157.69 18.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.1 m -98.84 128.53 45.07 Favored 'General case' 0 N--CA 1.414 -2.264 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.5 p -127.29 128.61 46.25 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.075 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 71' ' ' LYS . 41.2 t -106.93 131.05 57.88 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -86.64 112.7 21.86 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.1 p90 -126.2 133.23 51.59 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.867 -177.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -118.35 135.74 54.14 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.134 -1.026 . . . . 0.0 108.962 175.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.533 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 1.2 t80 -92.52 165.34 13.07 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -176.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -56.86 -31.95 65.32 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.45 0.643 . . . . 0.0 109.799 175.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.5 m -82.68 -8.73 59.58 Favored 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.959 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD2' ' H ' ' A' ' 13' ' ' PHE . 65.5 mttm -108.66 146.33 33.6 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 121.928 -0.483 . . . . 0.0 110.72 -177.021 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.4 tp -92.65 -46.19 7.71 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 171.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -97.24 155.87 16.67 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.778 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -75.8 135.96 40.25 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 121.305 0.574 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -94.74 177.85 5.78 Favored 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -137.48 128.11 26.85 Favored 'General case' 0 C--N 1.28 -2.44 0 CA-C-N 118.432 0.56 . . . . 0.0 111.462 -174.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.528 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -113.22 136.28 50.07 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.0 p -112.28 138.76 48.52 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 120.849 0.357 . . . . 0.0 111.517 -178.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.567 ' HE1' HG23 ' A' ' 9' ' ' VAL . 35.1 p90 -151.57 176.3 11.48 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.69 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -103.82 150.11 24.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 175.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.07 161.52 34.19 Favored Glycine 0 C--N 1.303 -1.296 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 tt -71.88 -32.79 67.79 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 118.074 0.937 . . . . 0.0 108.841 -177.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.518 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -138.5 159.8 41.16 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.369 -176.142 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.8 tt -128.66 128.15 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.593 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -56.83 142.27 41.53 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.893 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.2 tp -58.23 -34.77 70.8 Favored 'General case' 0 N--CA 1.419 -1.994 0 C-N-CA 124.738 1.215 . . . . 0.0 110.727 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.698 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 11.7 t -58.36 -46.49 86.2 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -74.42 -41.46 60.84 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.613 -176.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.5 tm? -59.0 -47.34 85.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.001 1.32 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.5 mtmt -67.05 -43.29 83.08 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 120.535 0.207 . . . . 0.0 111.021 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.698 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.92 -35.19 77.67 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.83 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.03 -49.95 72.62 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 120.881 0.372 . . . . 0.0 110.152 175.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.8 mt -69.17 -44.85 80.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.739 -175.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 73.8 mtm -66.05 -39.89 90.49 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.238 -178.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.24 -37.11 86.22 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.038 -1.077 . . . . 0.0 111.221 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -65.43 -49.03 70.69 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 123.065 0.546 . . . . 0.0 111.836 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 46.5 mt-10 -103.34 19.6 19.36 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.8 mmtt 62.16 34.11 16.44 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.676 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.8 mp -71.96 132.77 44.77 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.068 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 16.4 ptpt -71.86 101.4 2.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 122.144 0.973 . . . . 0.0 111.293 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.71 -7.91 57.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.896 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.83 -0.4 45.23 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.574 0.702 . . . . 0.0 110.349 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.465 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 9.3 t70 -113.05 -41.18 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.032 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -133.34 166.7 21.89 Favored 'General case' 0 N--CA 1.415 -2.225 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.459 -174.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.492 ' HB2' HG22 ' A' ' 82' ' ' ILE . 48.7 t0 -116.86 166.66 11.9 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 174.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.546 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 14.2 tp -112.79 125.45 54.36 Favored 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -111.52 109.04 18.77 Favored 'General case' 0 C--N 1.284 -2.277 0 O-C-N 121.777 -0.577 . . . . 0.0 109.709 -177.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.467 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.9 mp -99.69 125.65 53.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 CA-C-O 121.388 0.613 . . . . 0.0 110.084 -176.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.9 m -115.22 137.1 52.39 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.7 t-20 -67.15 138.24 56.89 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.76 -20.82 41.83 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.499 0.666 . . . . 0.0 111.263 -177.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -98.83 -47.33 5.33 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.384 -174.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 42.8 p -95.15 -22.59 17.76 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.4 0.619 . . . . 0.0 109.938 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 69.68 21.58 6.51 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 125.394 1.478 . . . . 0.0 111.538 -175.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.52 119.53 12.47 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.669 -1.151 . . . . 0.0 108.419 176.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -90.16 121.02 31.82 Favored 'General case' 0 N--CA 1.411 -2.386 0 CA-C-O 121.522 0.677 . . . . 0.0 110.889 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -93.21 100.77 13.08 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -100.64 -22.34 14.96 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.768 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' O ' HD23 ' A' ' 31' ' ' LEU . 7.2 t70 -99.94 137.87 37.79 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.625 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -60.03 -19.55 53.26 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -78.4 -8.73 58.8 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.9 152.16 45.1 Favored 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.518 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.4 138.6 52.98 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 118.604 0.638 . . . . 0.0 112.516 -176.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.21 115.23 38.28 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.57 173.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 47.3 Cg_endo -77.76 151.39 28.15 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.991 2.46 . . . . 0.0 113.016 174.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.588 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -67.18 -10.87 54.79 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.973 0.892 . . . . 0.0 113.294 -177.714 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -87.18 -4.77 59.13 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.875 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.6 m -109.73 143.15 39.92 Favored 'General case' 0 N--CA 1.426 -1.648 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.1 m -103.58 129.08 50.75 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.5 m -124.45 159.59 30.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -174.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -101.39 134.49 41.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.1 t -114.58 114.44 46.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 CA-C-O 121.053 0.454 . . . . 0.0 109.784 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -113.62 132.29 55.81 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.613 -177.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -85.96 121.88 29.22 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.587 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -123.25 147.99 53.67 Favored Pre-proline 0 C--O 1.206 -1.221 0 C-N-CA 120.551 -0.46 . . . . 0.0 109.916 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.31 138.13 38.48 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 121.989 1.793 . . . . 0.0 111.255 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.492 HG22 ' HB2' ' A' ' 50' ' ' ASP . 16.7 pt -71.14 -38.48 71.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.346 176.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.3 -69.47 0.5 Allowed Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.641 -176.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -143.11 -5.55 0.72 Allowed Glycine 0 N--CA 1.418 -2.532 0 CA-C-N 114.79 -0.705 . . . . 0.0 112.267 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 82' ' ' ILE . 27.1 m -80.11 95.92 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-O 122.379 1.085 . . . . 0.0 111.528 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 C--N 1.296 -1.72 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.05 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.773 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.493 ' HB2' ' HB2' ' A' ' 5' ' ' SER . 13.7 Cg_exo -71.86 128.91 14.68 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.918 2.412 . . . . 0.0 111.377 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.36 -63.22 1.45 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 120.951 0.405 . . . . 0.0 111.257 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.77 5.52 84.81 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 113.911 -173.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.493 ' HB2' ' HB2' ' A' ' 2' ' ' PRO . 56.7 m -94.23 5.08 52.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.449 -0.501 . . . . 0.0 112.113 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 97.0 mmm -68.92 136.65 52.91 Favored 'General case' 0 CA--C 1.495 -1.165 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.492 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 18.0 m -80.97 110.63 16.69 Favored 'General case' 0 N--CA 1.402 -2.851 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.113 -171.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -138.69 129.04 25.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.091 -177.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 21' ' ' THR . 51.3 t -107.23 132.12 55.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.502 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 49.4 m-70 -80.8 108.83 14.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.58 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 32.8 p90 -124.37 137.48 54.46 Favored 'General case' 0 C--N 1.281 -2.373 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -120.32 133.29 55.48 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 174.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -88.88 153.71 20.83 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 -177.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.2 p -68.45 -12.45 61.21 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.383 0.611 . . . . 0.0 111.484 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.9 p -87.78 -9.72 53.11 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.307 0.575 . . . . 0.0 109.884 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -113.66 -176.96 3.02 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.3 tp -134.23 -20.69 1.88 Allowed 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.346 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -104.77 157.37 17.24 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.23 147.68 27.86 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.455 175.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 6.9 t70 -123.43 178.69 5.04 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 5.6 p -130.05 115.41 17.06 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 118.551 0.614 . . . . 0.0 110.916 -173.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -95.54 135.62 29.08 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.018 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 7' ' ' SER . 10.0 p -105.46 146.04 30.04 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -174.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.5 p90 -156.51 176.44 12.7 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -113.06 135.0 54.27 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 173.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.53 177.43 16.32 Favored Glycine 0 N--CA 1.425 -2.04 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -81.47 -32.41 32.54 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.64 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -148.99 160.08 43.64 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.973 -175.979 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.4 tt -126.24 128.01 71.22 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.008 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.8 m -61.94 147.93 45.28 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.35 0.66 . . . . 0.0 111.093 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 43.5 tp -54.67 -46.34 74.01 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.485 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -56.05 -45.31 79.26 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 120.969 0.414 . . . . 0.0 109.959 179.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.04 -41.23 82.39 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.611 0.719 . . . . 0.0 111.073 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.8 -46.8 87.95 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.555 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HA ' HD23 ' A' ' 51' ' ' LEU . 57.9 mtmt -66.11 -39.39 89.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.828 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.7 mptp? -61.63 -39.38 91.1 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.227 0.329 . . . . 0.0 111.488 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -66.62 -47.69 71.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.273 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.11 -47.39 78.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.4 mtm -64.72 -38.26 90.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.908 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.55 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.925 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -71.92 -50.14 31.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.079 0.466 . . . . 0.0 111.327 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.32 -9.75 58.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.486 -173.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm 71.71 62.29 0.15 Allowed 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 125.316 1.446 . . . . 0.0 110.564 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.03 158.36 15.59 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.044 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -106.83 104.41 14.09 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 122.171 0.986 . . . . 0.0 109.706 176.844 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.65 61.8 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.158 -176.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.49 58.09 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.188 0.518 . . . . 0.0 110.782 178.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.596 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 19.2 t70 -117.04 -39.61 3.21 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.727 0.775 . . . . 0.0 110.102 178.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.5 p -138.8 160.81 38.78 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.833 -174.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.482 ' HB2' HG22 ' A' ' 82' ' ' ILE . 33.8 t70 -115.31 167.39 10.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 177.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.0 tp -114.57 109.82 18.85 Favored 'General case' 0 N--CA 1.404 -2.747 0 CA-C-O 121.502 0.668 . . . . 0.0 109.62 -174.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.0 tt0 -94.15 120.78 34.88 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -176.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.468 HD11 ' HG ' ' A' ' 51' ' ' LEU . 25.8 mm -109.02 130.87 61.21 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.472 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -176.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.8 m -120.38 147.54 44.92 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.487 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.6 t-20 -78.33 138.67 38.68 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.07 37.77 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.444 0.64 . . . . 0.0 110.933 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -95.79 -51.89 4.31 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.594 -173.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -89.73 -18.27 26.68 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.524 0.678 . . . . 0.0 109.789 -176.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.6 mmmt 65.4 24.13 12.01 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.078 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -84.75 129.45 34.82 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -85.87 127.42 34.58 Favored 'General case' 0 N--CA 1.417 -2.086 0 CA-C-O 121.626 0.727 . . . . 0.0 109.716 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.14 93.91 8.25 Favored 'General case' 0 C--N 1.272 -2.765 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.074 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -88.36 -28.35 21.03 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.342 -1.299 . . . . 0.0 113.446 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -99.9 146.08 27.07 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.6 m-20 -73.34 -5.95 42.98 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -85.5 -11.76 53.42 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.888 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 31' ' ' LEU . . . -60.71 114.08 2.82 Favored 'General case' 0 C--O 1.203 -1.345 0 O-C-N 124.074 0.859 . . . . 0.0 111.298 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.64 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -91.6 138.65 31.4 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.443 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.73 115.6 43.78 Favored Pre-proline 0 C--N 1.301 -1.5 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.669 173.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.6 Cg_endo -79.57 158.5 25.31 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.449 2.766 . . . . 0.0 113.232 176.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 52.5 pttt -68.48 -4.33 14.6 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.617 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -86.74 -11.09 52.12 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.209 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.6 m -118.71 154.33 32.93 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 m -109.37 131.76 54.77 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.47 HG12 ' HA ' ' A' ' 55' ' ' ASN . 19.0 m -126.11 157.44 36.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-O 121.854 0.835 . . . . 0.0 112.882 -175.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mm -99.23 127.25 52.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.435 ' CG1' HD11 ' A' ' 51' ' ' LEU . 58.3 t -108.45 114.31 46.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.382 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -118.4 138.64 52.31 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.566 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -93.33 122.92 36.24 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.568 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -124.08 153.8 68.05 Favored Pre-proline 0 C--N 1.31 -1.149 0 O-C-N 122.195 -0.315 . . . . 0.0 110.596 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.61 136.2 30.19 Favored 'Trans proline' 0 C--N 1.323 -0.776 0 C-N-CA 121.828 1.685 . . . . 0.0 111.199 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.482 HG22 ' HB2' ' A' ' 50' ' ' ASP . 12.1 pt -72.62 -22.18 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.016 0.436 . . . . 0.0 109.875 176.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 105.35 -34.06 6.07 Favored Glycine 0 N--CA 1.426 -1.972 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.37 -58.81 0.39 Allowed Glycine 0 CA--C 1.482 -2.011 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -177.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.12 124.76 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 172.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 93.4 mttt . . . . . 0 C--N 1.29 -1.999 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.86 -175.573 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.832 0 N-CA-C 110.406 -1.077 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -82.67 158.85 16.48 Favored 'Trans proline' 0 N--CA 1.436 -1.91 0 C-N-CA 122.303 2.002 . . . . 0.0 112.405 -176.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp -111.46 11.24 21.4 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.42 63.89 2.17 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.163 -1.575 . . . . 0.0 109.163 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.0 p -69.49 -24.49 63.77 Favored 'General case' 0 CA--C 1.495 -1.168 0 CA-C-O 121.39 0.614 . . . . 0.0 112.477 -175.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.4 mtp -91.08 86.76 6.32 Favored 'General case' 0 C--N 1.285 -2.235 0 CA-C-O 122.62 1.2 . . . . 0.0 108.137 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.3 m -87.68 122.06 30.89 Favored 'General case' 0 C--N 1.255 -3.506 0 CA-C-N 113.304 -1.771 . . . . 0.0 106.802 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.606 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.1 p -133.39 134.6 43.9 Favored 'General case' 0 C--N 1.294 -1.829 0 C-N-CA 120.22 -0.592 . . . . 0.0 111.41 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.5 HG23 ' CE1' ' A' ' 24' ' ' PHE . 52.0 t -107.32 123.42 62.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.861 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -78.3 114.36 17.12 Favored 'General case' 0 N--CA 1.419 -2.001 0 O-C-N 124.152 0.907 . . . . 0.0 108.907 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.524 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 50.0 p90 -125.05 131.94 53.28 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -117.37 131.22 56.82 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 118.404 -1.318 . . . . 0.0 109.304 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.453 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -86.17 156.68 20.23 Favored 'General case' 0 C--N 1.273 -2.748 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -177.515 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.3 p -60.26 -27.79 67.53 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.243 0.544 . . . . 0.0 110.527 175.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.6 m -96.78 8.43 44.33 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.703 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HD3' ' CB ' ' A' ' 13' ' ' PHE . 5.9 mptp? -108.69 157.16 18.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.11 -34.24 13.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.197 0.522 . . . . 0.0 110.52 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -133.37 175.98 8.93 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -77.11 141.82 40.03 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.336 0.589 . . . . 0.0 111.38 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -108.33 177.31 4.83 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 p -136.79 136.47 38.88 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -175.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -98.72 122.27 50.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 167.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.0 p -93.86 123.54 37.28 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.5 ' CE1' HG23 ' A' ' 9' ' ' VAL . 47.0 p90 -140.94 177.36 8.1 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -178.025 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -120.27 118.59 30.84 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.461 0.573 . . . . 0.0 112.355 -175.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 134.69 -113.89 1.2 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.86 174.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -131.48 -45.23 0.99 Allowed 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.613 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -141.18 161.66 37.35 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -125.16 127.75 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.133 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.8 m -58.83 137.92 57.51 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.525 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.441 HD11 ' CG1' ' A' ' 53' ' ' ILE . 53.2 tp -54.79 -41.7 70.88 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 124.432 1.093 . . . . 0.0 112.672 -175.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 8.1 t -57.42 -45.42 84.64 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.2 t70 -66.41 -42.36 87.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -64.94 -46.87 79.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.883 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.564 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 41.3 mtmt -69.04 -37.89 78.84 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.813 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.7 mptt -61.84 -39.49 92.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.003 177.2 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 74.7 mt-30 -64.02 -50.88 66.71 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.018 177.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.79 -46.59 96.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.854 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG2' HD22 ' A' ' 44' ' ' LEU . 67.3 mtm -64.92 -38.34 90.63 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.879 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.86 -33.31 57.84 Favored Glycine 0 C--N 1.315 -0.636 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.156 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -72.96 -48.49 36.26 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 123.463 0.705 . . . . 0.0 112.013 -177.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -95.47 -0.45 52.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.166 0.508 . . . . 0.0 112.125 -173.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.419 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 44.5 mmtt 67.35 68.23 0.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.904 177.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD22 ' HG2' ' A' ' 39' ' ' MET . 11.1 mp -98.1 170.74 8.7 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.075 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -109.88 101.7 10.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.501 0.667 . . . . 0.0 110.106 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.15 -9.04 59.87 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 123.683 0.793 . . . . 0.0 111.271 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.3 -5.63 54.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.496 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.8 t70 -131.54 -29.82 1.72 Allowed 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.06 0.933 . . . . 0.0 110.814 -176.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.5 m -130.01 159.35 36.96 Favored 'General case' 0 N--CA 1.399 -3.004 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -176.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.628 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 5.7 t0 -118.36 169.56 9.64 Favored 'General case' 0 C--N 1.287 -2.119 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 175.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.564 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 24.0 tp -114.15 119.02 35.68 Favored 'General case' 0 C--N 1.248 -3.812 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.502 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.5 tt0 -113.22 117.2 31.21 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 -175.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.441 ' CG1' HD11 ' A' ' 31' ' ' LEU . 39.2 mm -99.91 135.55 35.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.695 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -176.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 m -123.65 145.36 49.01 Favored 'General case' 0 C--N 1.287 -2.145 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -71.17 139.29 50.14 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.766 -0.584 . . . . 0.0 109.915 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.22 56.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.921 0.391 . . . . 0.0 111.336 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -94.69 -48.29 6.13 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.69 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.2 p -95.31 -19.24 20.14 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.769 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 59.58 41.62 18.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -94.94 126.63 40.4 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -80.87 135.42 35.92 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-O 120.848 0.356 . . . . 0.0 110.238 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -94.0 100.45 12.58 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -83.2 -47.32 11.69 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.682 -1.145 . . . . 0.0 114.06 -170.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -90.97 147.48 23.07 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -78.11 -1.43 32.45 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.298 0.57 . . . . 0.0 112.306 -176.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -92.79 -2.43 55.96 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.943 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.55 148.64 51.39 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 174.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.613 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -118.91 138.76 52.54 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 118.237 0.471 . . . . 0.0 111.634 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.26 117.25 36.81 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.239 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.4 Cg_endo -78.34 154.43 28.2 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 123.779 2.986 . . . . 0.0 114.514 177.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -65.05 -10.52 30.69 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.397 1.079 . . . . 0.0 111.776 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.57 -10.46 51.5 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.049 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.9 m -107.57 155.37 20.19 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.291 0.567 . . . . 0.0 111.435 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -118.85 132.91 56.13 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 173.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 55' ' ' ASN . 18.8 m -128.64 162.38 35.64 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -104.45 132.84 50.12 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.484 ' CG1' HD11 ' A' ' 51' ' ' LEU . 42.8 t -106.46 113.96 44.43 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.178 0 CA-C-O 121.206 0.526 . . . . 0.0 110.015 -178.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 24.8 tpp180 -110.38 125.11 52.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.102 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -90.28 120.21 31.23 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 174.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.502 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.03 152.25 50.08 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.683 -176.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -76.8 140.85 21.08 Favored 'Trans proline' 0 C--O 1.245 0.856 0 C-N-CA 122.212 1.941 . . . . 0.0 111.053 176.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.628 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.9 pt -95.07 -32.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.51 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.91 -25.0 1.53 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 -173.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.49 ' H ' ' C ' ' A' ' 82' ' ' ILE . . . 108.49 5.29 32.08 Favored Glycine 0 N--CA 1.415 -2.701 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -176.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.42 86.97 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.249 1.037 0 CA-C-O 121.805 0.812 . . . . 0.0 111.794 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--N 1.299 -1.6 0 N-CA-C 106.44 -1.689 . . . . 0.0 106.44 176.768 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.737 0 N-CA-C 110.459 -1.057 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.53 -70.76 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.662 2.242 . . . . 0.0 111.875 -178.293 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 81.9 mt -125.91 155.51 41.15 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.39 48.04 20.12 Favored Glycine 0 N--CA 1.442 -0.929 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -175.432 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.1 m -144.83 35.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.042 -0.579 . . . . 0.0 109.748 -176.327 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.24 149.35 45.74 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.924 0.869 . . . . 0.0 112.214 178.071 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -102.71 127.17 49.95 Favored 'General case' 0 C--N 1.28 -2.442 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.94 -175.484 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.6 p -137.36 138.9 40.4 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.528 -179.297 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.554 HG23 ' HE1' ' A' ' 24' ' ' PHE . 41.5 t -107.38 134.98 47.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.467 -179.702 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -82.95 109.68 17.27 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 174.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.6 p90 -122.5 134.4 54.57 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -115.74 132.11 56.73 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 117.744 -1.583 . . . . 0.0 109.174 175.78 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.31 155.65 17.4 Favored 'General case' 0 C--N 1.275 -2.645 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -62.62 -25.8 68.29 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.578 0.704 . . . . 0.0 110.655 175.601 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.1 -3.09 50.83 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.984 178.336 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -106.31 172.39 6.84 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.8 tp -102.1 -45.8 5.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 176.517 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -122.69 -171.01 2.19 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.167 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.9 148.1 34.73 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.496 0.665 . . . . 0.0 111.623 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -114.45 178.51 4.26 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 176.725 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 3.1 p -132.17 131.97 42.75 Favored 'General case' 0 N--CA 1.414 -2.242 0 CA-C-N 118.908 0.776 . . . . 0.0 110.64 -175.505 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.6 p -110.2 130.77 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.191 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 176.404 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -102.03 141.94 34.1 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -174.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.9 p90 -155.76 177.38 11.46 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -116.86 155.49 28.93 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.13 -135.64 12.96 Favored Glycine 0 C--N 1.31 -0.912 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 -178.715 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.451 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 2.8 tm? -122.9 -42.84 2.27 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.489 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -136.29 159.01 43.05 Favored 'General case' 0 CA--C 1.478 -1.804 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.662 -177.274 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -121.21 126.71 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.638 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.5 m -57.64 140.53 50.91 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.178 176.659 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 62' ' ' TYR . 50.1 tp -57.87 -40.26 79.78 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 123.17 0.588 . . . . 0.0 112.491 -176.319 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 19.7 t -55.18 -46.92 75.84 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.622 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -66.03 -47.7 73.56 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.74 179.611 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.91 -46.61 89.97 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 123.561 0.538 . . . . 0.0 112.14 -177.066 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' HD23 ' A' ' 51' ' ' LEU . 50.1 mtmt -66.08 -45.13 82.34 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.302 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -62.0 -35.56 78.89 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.271 0.357 . . . . 0.0 111.1 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 29.3 mm-40 -63.7 -50.6 68.55 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.425 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.6 mt -66.25 -45.57 89.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.566 -176.202 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 67.8 mtm -64.66 -40.5 95.54 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.278 -177.832 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.04 -41.59 47.43 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.235 179.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.63 -47.37 63.65 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 17.6 mm-40 -89.55 -2.74 58.43 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt 71.21 65.92 0.16 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 125.153 1.381 . . . . 0.0 111.288 178.825 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.436 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.9 mp -103.38 156.99 17.34 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.124 -0.944 . . . . 0.0 108.582 175.516 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -94.31 100.62 12.63 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 122.005 0.907 . . . . 0.0 109.782 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.08 -17.04 61.0 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.108 -174.105 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -98.2 1.73 47.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 179.718 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -124.3 -28.17 3.7 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.232 -0.987 . . . . 0.0 111.581 -177.423 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.4 p -135.68 159.65 40.98 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.716 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -108.47 157.34 18.53 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -179.657 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.455 HD11 ' CG1' ' A' ' 77' ' ' VAL . 23.6 tp -113.1 116.62 30.16 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.067 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.497 ' HB2' HG12 ' A' ' 80' ' ' ILE . 25.1 tt0 -116.21 115.08 25.35 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 121.806 0.812 . . . . 0.0 109.645 -176.568 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.425 HD12 HG22 ' A' ' 77' ' ' VAL . 27.4 mm -97.25 135.55 31.11 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 -174.293 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 m -121.19 141.36 50.93 Favored 'General case' 0 C--N 1.283 -2.294 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.467 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 12.4 t-20 -75.1 139.75 42.98 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.677 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.0 -28.54 39.42 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.336 0.589 . . . . 0.0 111.173 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -92.09 -49.18 6.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.425 -174.718 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.1 p -93.64 -19.79 20.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.982 0.42 . . . . 0.0 110.129 -174.927 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.2 mmmt 65.75 24.01 11.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.559 1.144 . . . . 0.0 111.139 -178.099 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -82.29 131.3 35.23 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.59 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -90.36 135.27 33.79 Favored 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 177.224 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 63.2 m-85 -101.25 97.12 7.67 Favored 'General case' 0 C--N 1.263 -3.19 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.223 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -100.15 -25.39 14.3 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.985 -177.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -94.07 128.99 40.77 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -176.193 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -61.6 -10.74 8.9 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -91.68 -2.08 57.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.637 -178.363 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.29 151.14 47.35 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.556 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.16 138.94 52.59 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 118.385 0.539 . . . . 0.0 111.007 -177.642 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.48 113.98 36.45 Favored Pre-proline 0 C--N 1.315 -0.93 0 C-N-CA 119.689 -0.805 . . . . 0.0 110.445 173.027 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.564 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.7 Cg_endo -79.43 158.68 25.79 Favored 'Trans proline' 0 CA--C 1.519 -0.256 0 C-N-CA 123.128 2.552 . . . . 0.0 113.245 177.032 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -70.48 5.15 1.92 Allowed 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 121.57 0.7 . . . . 0.0 111.9 176.339 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -87.95 -20.52 25.78 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.023 172.891 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -103.42 141.7 35.52 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -174.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -104.0 128.43 51.56 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 169.199 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 ' HA ' ' A' ' 55' ' ' ASN . 14.6 m -123.17 157.28 28.87 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.7 mm -103.71 125.96 58.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.221 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.455 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.4 t -100.78 114.27 39.26 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-O 121.397 0.617 . . . . 0.0 110.429 -177.515 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -113.11 138.85 49.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.887 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -100.41 128.52 46.45 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.497 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -127.85 153.61 78.09 Favored Pre-proline 0 C--N 1.312 -1.036 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.467 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.28 134.31 24.57 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 121.977 1.784 . . . . 0.0 111.993 179.012 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 pt -65.81 -30.78 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-O 121.077 0.465 . . . . 0.0 111.644 178.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 106.23 -62.06 0.33 Allowed Glycine 0 N--CA 1.425 -2.064 0 C-N-CA 121.018 -0.61 . . . . 0.0 111.86 179.712 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -96.31 80.3 0.75 Allowed Glycine 0 N--CA 1.428 -1.899 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.011 -178.227 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.7 m -76.78 86.42 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-O 122.428 1.109 . . . . 0.0 110.621 177.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.1 pttm . . . . . 0 C--N 1.302 -1.495 0 CA-C-N 113.561 -1.654 . . . . 0.0 112.051 -178.507 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.366 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -79.02 3.37 7.47 Favored 'Trans proline' 0 C--O 1.245 0.83 0 C-N-CA 123.308 2.672 . . . . 0.0 112.885 -179.022 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 91.3 mt 69.76 -82.73 0.03 OUTLIER 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.259 1.424 . . . . 0.0 111.171 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -146.77 141.13 9.18 Favored Glycine 0 N--CA 1.424 -2.13 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.275 -179.637 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.2 m -75.54 -21.83 57.59 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-O 121.771 0.796 . . . . 0.0 110.263 178.024 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 86.5 mtp -77.25 105.7 8.52 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 172.836 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 71' ' ' LYS . 36.1 m -102.12 140.07 36.9 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.118 -172.18 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.7 p -139.59 134.84 32.68 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.629 -179.034 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' CE1' ' A' ' 24' ' ' PHE . 59.6 t -107.35 135.67 45.12 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.458 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -83.92 113.32 20.89 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.195 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 29.5 p90 -129.51 136.56 50.0 Favored 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.218 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -121.79 141.01 51.64 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 173.273 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.559 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -91.66 175.87 6.74 Favored 'General case' 0 C--N 1.277 -2.566 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 177.059 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -63.43 -30.65 71.74 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 171.162 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.4 m -79.53 -7.04 58.2 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.682 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.559 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 3.8 mptp? -105.06 134.25 48.48 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.302 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.27 -19.47 22.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.629 0.728 . . . . 0.0 109.226 178.129 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.449 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 8.2 p30 -129.96 173.92 10.25 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.553 179.012 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.89 129.05 36.96 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.268 0.556 . . . . 0.0 112.179 -177.511 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -89.58 177.59 6.51 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.55 -1.205 . . . . 0.0 108.47 175.092 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -135.76 131.49 35.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.169 0.509 . . . . 0.0 110.87 -177.238 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.5 p -113.75 127.54 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.086 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.751 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 7' ' ' SER . 8.5 p -99.83 143.69 29.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.374 0.606 . . . . 0.0 112.142 -176.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.532 ' CE1' HG23 ' A' ' 9' ' ' VAL . 17.2 p90 -153.23 171.03 19.14 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.157 178.014 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.14 135.33 51.82 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.12 -115.02 2.08 Favored Glycine 0 C--N 1.302 -1.341 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.548 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tt -149.14 -41.11 0.15 Allowed 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 1.1 p-80 -134.81 157.25 47.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 179.521 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 tt -122.78 125.67 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.993 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.553 -179.014 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.1 m -58.23 141.25 51.29 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.908 173.461 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.449 HD11 HD13 ' A' ' 53' ' ' ILE . 57.9 tp -54.63 -41.23 69.78 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.918 1.287 . . . . 0.0 111.409 -177.435 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.654 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 53.7 t -54.33 -45.24 72.63 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.452 178.198 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -72.63 -43.07 63.72 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 -176.562 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.499 ' CD2' HD13 ' A' ' 69' ' ' ILE . 0.6 OUTLIER -67.02 -40.85 87.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.24 -174.477 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.456 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 53.1 mtmt -62.36 -38.82 91.0 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.782 -179.431 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.654 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 3.9 mptp? -61.75 -40.42 95.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.638 177.876 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -63.18 -51.1 67.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.783 179.435 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.6 mt -68.81 -42.83 82.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.418 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.428 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.2 mtm -64.0 -35.25 80.07 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.384 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.5 -39.16 50.87 Favored Glycine 0 C--N 1.309 -0.924 0 C-N-CA 120.308 -0.948 . . . . 0.0 111.541 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -66.77 -43.41 84.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.893 0.877 . . . . 0.0 112.549 -177.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 76.5 mm-40 -99.95 3.61 44.46 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.882 0.373 . . . . 0.0 110.993 -178.741 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.4 mptt 57.86 66.51 1.11 Allowed 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.387 178.11 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -98.85 154.23 18.18 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.179 177.564 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 47' ' ' ALA . 23.7 ttmm -97.69 111.62 23.83 Favored 'General case' 0 N--CA 1.401 -2.893 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.795 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.98 -1.69 26.89 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.794 -178.37 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.33 -12.06 18.94 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.377 -177.038 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.89 -37.06 6.8 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.392 0.615 . . . . 0.0 110.323 -177.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.7 m -141.43 174.36 10.62 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.441 -178.442 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.514 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 6.3 t0 -119.44 169.87 9.65 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.9 tp -114.52 122.26 46.02 Favored 'General case' 0 C--N 1.273 -2.76 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -113.55 123.34 49.76 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -177.113 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.498 HG12 HD11 ' A' ' 34' ' ' LEU . 2.1 mp -102.94 132.11 49.8 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.84 0 C-N-CA 119.867 -0.733 . . . . 0.0 109.115 179.204 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.4 m -117.27 146.92 42.99 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 179.376 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.542 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.7 t-20 -74.59 138.6 43.11 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' HG13 ' A' ' 76' ' ' ILE . . . -76.88 -25.77 53.43 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-O 121.211 0.529 . . . . 0.0 110.379 -178.419 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -92.78 -56.52 2.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.553 -176.494 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.5 p -90.83 -16.27 28.57 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.248 -171.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 64.03 18.44 11.22 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -174.183 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.18 125.89 28.08 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 175.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -89.51 125.67 35.28 Favored 'General case' 0 C--N 1.288 -2.094 0 CA-C-O 121.298 0.57 . . . . 0.0 110.676 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -92.61 100.15 12.73 Favored 'General case' 0 C--N 1.278 -2.507 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.678 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.4 p -98.2 -26.09 14.67 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.743 -175.577 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -95.35 135.54 36.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.2 m-20 -64.19 -17.85 63.93 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.493 0.717 . . . . 0.0 110.784 -178.073 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -81.64 -8.75 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.727 -178.597 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.83 144.36 56.66 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.624 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.73 137.68 52.53 Favored 'General case' 0 C--N 1.294 -1.835 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -176.805 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.499 HD13 ' CD2' ' A' ' 34' ' ' LEU . 3.8 mp -119.69 116.48 33.16 Favored Pre-proline 0 C--N 1.302 -1.477 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.236 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.525 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 75.8 Cg_endo -80.75 160.8 21.64 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.373 2.716 . . . . 0.0 113.879 177.735 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 7' ' ' SER . 53.4 pttt -63.79 -8.74 11.58 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.93 175.504 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -81.48 -17.38 48.88 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.646 178.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 37.8 m -105.81 152.74 22.85 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.784 0.802 . . . . 0.0 111.856 -175.151 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 m -114.45 129.75 56.68 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 170.184 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.652 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.6 m -128.57 164.28 30.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 120.909 0.385 . . . . 0.0 110.917 -176.362 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 56' ' ' ALA . 51.0 mt -122.8 129.04 75.43 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 53' ' ' ILE . 20.3 t -100.39 132.62 45.67 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.468 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.089 -173.091 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -130.26 143.16 50.61 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 -176.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -97.36 134.07 41.12 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.596 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 pp -124.77 148.9 60.88 Favored Pre-proline 0 C--N 1.303 -1.429 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.934 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.61 132.27 18.59 Favored 'Trans proline' 0 N--CA 1.447 -1.254 0 C-N-CA 122.188 1.925 . . . . 0.0 111.713 178.761 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.524 HG13 ' H ' ' A' ' 84' ' ' GLY . 31.5 pt -84.01 -22.43 8.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.392 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 137.2 -27.78 2.85 Favored Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.524 ' H ' HG13 ' A' ' 82' ' ' ILE . . . 137.21 178.32 15.79 Favored Glycine 0 N--CA 1.412 -2.96 0 N-CA-C 108.666 -1.774 . . . . 0.0 108.666 -179.873 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 65.5 t -78.3 97.85 2.3 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.907 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.478 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.6 pttt . . . . . 0 C--N 1.302 -1.486 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.164 -177.634 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.331 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -62.02 -53.56 2.0 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 123.151 2.567 . . . . 0.0 113.21 -177.992 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 pp -73.36 -25.42 60.58 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.463 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.57 85.17 0.27 Allowed Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 178.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.7 m -85.3 76.05 10.18 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.71 0.767 . . . . 0.0 110.05 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 85.9 mtp -80.75 162.49 24.07 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.587 179.548 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.4 m -115.04 116.46 28.48 Favored 'General case' 0 N--CA 1.405 -2.684 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.325 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.543 ' SG ' HG22 ' A' ' 23' ' ' THR . 83.8 m -138.38 133.51 33.0 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.917 -174.479 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.55 HG23 ' CE1' ' A' ' 24' ' ' PHE . 79.1 t -106.14 130.52 57.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 42.7 m-70 -88.63 120.17 29.78 Favored 'General case' 0 CA--C 1.482 -1.652 0 O-C-N 124.227 0.954 . . . . 0.0 109.106 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.632 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.1 p90 -132.95 139.93 47.56 Favored 'General case' 0 C--N 1.278 -2.515 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.22 148.49 43.62 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.536 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -85.97 165.45 16.72 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.957 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -66.08 -30.9 71.5 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.41 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.2 t -74.34 -57.11 4.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.87 176.422 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 13' ' ' PHE . 54.5 mtmt -67.4 143.22 56.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.094 0.557 . . . . 0.0 111.7 -178.555 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.15 -37.65 14.05 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.162 -175.178 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -100.76 163.23 12.42 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.528 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -87.94 152.17 22.26 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.374 0.607 . . . . 0.0 111.553 -177.928 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.47 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.8 t70 -121.71 176.69 5.59 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 176.449 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 4.6 p -133.33 131.17 39.81 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.667 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -95.5 117.33 39.26 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.165 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 170.157 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.543 HG22 ' SG ' ' A' ' 8' ' ' CYS . 39.9 p -86.01 121.41 28.59 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.406 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.566 ' O ' ' HB2' ' A' ' 7' ' ' SER . 16.0 p90 -143.24 161.6 37.85 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -178.106 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -101.13 132.51 46.57 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.0 -163.39 23.49 Favored Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -177.524 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 58.0 tp -106.97 -35.52 6.88 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 176.922 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.532 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -144.3 156.94 44.48 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.261 -179.242 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -126.14 131.15 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.91 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.432 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.8 m -64.98 145.54 56.2 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.131 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 47.6 tp -54.87 -46.27 74.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -172.672 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.491 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 12.7 t -58.57 -42.73 88.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 118.994 0.815 . . . . 0.0 109.87 179.412 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 6.1 m-20 -65.06 -43.51 92.0 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.132 179.193 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.29 -46.34 90.17 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.893 -179.685 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 52.4 mtmt -66.78 -40.57 88.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 -179.92 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.2 mptt -61.87 -34.41 75.96 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.668 178.116 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 13.3 mm100 -65.4 -50.1 66.75 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 110.102 176.115 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.3 mt -68.61 -47.13 78.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.604 -176.689 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.0 mtm -63.09 -44.3 96.11 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.17 -178.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -39.03 91.56 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.834 179.009 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.03 -51.51 63.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.085 0.469 . . . . 0.0 110.745 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -97.43 11.26 37.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -171.366 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt 67.67 38.89 2.88 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.426 1.09 . . . . 0.0 112.036 171.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.07 167.34 22.05 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.388 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -105.47 102.43 11.9 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.681 178.762 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.62 -13.7 60.04 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.52 -176.792 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.58 -6.85 59.12 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.871 -179.1 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.535 ' O ' HG12 ' A' ' 82' ' ' ILE . 32.0 t70 -126.62 -33.08 2.57 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.511 0.672 . . . . 0.0 111.107 178.801 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.3 m -129.27 161.71 29.58 Favored 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.337 -175.867 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.453 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 10.5 t70 -118.81 171.26 8.34 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 178.171 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.464 HD11 ' CG1' ' A' ' 77' ' ' VAL . 18.2 tp -118.48 117.69 29.71 Favored 'General case' 0 N--CA 1.395 -3.193 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -174.067 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.482 HE21 HG22 ' A' ' 63' ' ' THR . 1.2 tp60 -101.4 123.53 45.62 Favored 'General case' 0 C--N 1.284 -2.249 0 O-C-N 120.932 -1.105 . . . . 0.0 108.408 -177.714 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 51' ' ' LEU . 32.8 mm -110.23 130.67 63.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -173.222 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.7 m -117.13 139.48 50.68 Favored 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.371 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.8 t-20 -65.79 136.5 56.28 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 176.031 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.33 -26.18 55.51 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.254 0.549 . . . . 0.0 111.427 -177.41 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -95.69 -52.2 4.2 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.28 -176.605 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -90.16 -18.61 25.47 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.25 0.548 . . . . 0.0 110.223 -174.112 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 66.05 21.83 11.21 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.731 1.212 . . . . 0.0 112.153 -177.239 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -70.72 121.63 18.32 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.597 174.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -90.18 117.98 29.35 Favored 'General case' 0 N--CA 1.405 -2.723 0 CA-C-O 122.0 0.905 . . . . 0.0 110.838 -178.06 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -87.63 92.84 9.25 Favored 'General case' 0 C--N 1.272 -2.767 0 CA-C-N 114.101 -1.408 . . . . 0.0 107.75 -179.583 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.482 HG22 HE21 ' A' ' 52' ' ' GLN . 23.8 p -93.23 -17.77 23.28 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.375 -176.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -101.55 128.82 47.63 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.388 -178.169 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 7.8 p-10 -67.72 -7.08 24.23 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.501 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -90.79 -2.87 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.447 176.289 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.2 150.56 47.34 Favored 'General case' 0 C--O 1.206 -1.205 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.203 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.532 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.04 138.33 52.29 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 118.085 0.402 . . . . 0.0 110.84 -177.071 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.28 116.04 37.63 Favored Pre-proline 0 C--N 1.314 -0.956 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.563 176.11 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.0 Cg_endo -79.39 158.77 25.96 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 123.162 2.574 . . . . 0.0 113.418 176.036 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -66.67 -10.26 44.49 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.659 178.194 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -87.77 -3.88 58.92 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.386 178.945 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -112.59 150.88 30.76 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 121.261 0.553 . . . . 0.0 111.476 -178.091 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -109.73 126.7 54.0 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.213 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 13.9 m -124.57 164.77 22.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.424 0.63 . . . . 0.0 112.553 -176.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -124.3 136.07 61.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 C-N-CA 124.295 1.038 . . . . 0.0 108.728 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.464 ' CG1' HD11 ' A' ' 51' ' ' LEU . 41.2 t -104.17 129.28 56.69 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.612 -172.323 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -129.01 140.65 51.55 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.311 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -98.64 131.94 44.43 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.607 178.789 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -128.93 152.84 79.82 Favored Pre-proline 0 C--O 1.206 -1.199 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.029 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -74.0 134.69 20.01 Favored 'Trans proline' 0 C--N 1.318 -1.069 0 C-N-CA 122.308 2.006 . . . . 0.0 111.579 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 48' ' ' ASP . 10.6 pt -66.65 -41.11 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.022 178.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.33 -45.23 25.26 Favored Glycine 0 N--CA 1.44 -1.097 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.06 -87.56 0.48 Allowed Glycine 0 C--N 1.304 -1.231 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.701 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.5 t -75.13 110.05 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 -179.001 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 C--N 1.293 -1.854 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 178.226 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.229 0 CA-C-O 119.177 -0.791 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -63.61 -40.97 27.22 Favored 'Trans proline' 0 C--N 1.361 1.197 0 C-N-CA 122.853 2.369 . . . . 0.0 112.723 -178.664 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.9 tp -158.64 99.73 1.59 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.071 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.77 9.75 5.21 Favored Glycine 0 C--N 1.301 -1.363 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.485 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.6 m 62.53 85.31 0.13 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 110.902 -177.353 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.2 mtp -65.76 115.93 6.42 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.688 177.372 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.474 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 64.1 m -89.82 135.52 33.58 Favored 'General case' 0 N--CA 1.412 -2.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.497 -178.663 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 27.3 p -144.25 144.48 31.53 Favored 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.531 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.2 t -105.57 132.43 52.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.331 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -82.84 104.7 13.26 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CD2' HG21 ' A' ' 77' ' ' VAL . 38.2 p90 -120.71 141.23 50.62 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 -177.426 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -124.51 126.09 45.29 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 118.102 -1.439 . . . . 0.0 110.164 175.685 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.26 157.2 19.99 Favored 'General case' 0 C--N 1.286 -2.166 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 178.176 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.7 m -60.0 -25.06 64.97 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 120.809 0.338 . . . . 0.0 111.53 177.479 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 t -95.1 -4.75 45.69 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 121.549 0.69 . . . . 0.0 110.615 178.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.24 -43.3 11.08 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 121.712 -0.618 . . . . 0.0 110.642 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 71.89 -47.31 0.66 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.478 1.511 . . . . 0.0 111.722 -176.492 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -100.92 169.44 8.97 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 175.42 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -83.36 144.96 29.31 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.536 0.684 . . . . 0.0 112.059 -176.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -113.91 177.97 4.45 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 176.012 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.68 123.0 17.05 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.519 0.599 . . . . 0.0 110.875 -174.005 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -102.36 119.68 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 176.696 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 p -87.58 134.52 33.61 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.138 -178.731 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.531 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.7 p90 -144.79 176.0 9.77 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.715 -177.287 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -103.9 131.19 51.37 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.73 179.83 20.88 Favored Glycine 0 C--O 1.209 -1.407 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.338 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -83.49 -31.62 26.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.54 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -136.93 157.35 46.95 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.58 -177.862 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.06 132.48 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.783 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.573 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.461 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 6.3 m -60.83 145.49 49.72 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.408 0.683 . . . . 0.0 109.976 177.139 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.9 tp -57.7 -43.1 84.94 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 124.134 0.974 . . . . 0.0 112.729 -176.306 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.5 t -59.13 -45.6 90.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.222 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.636 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 14.1 m-20 -62.71 -48.77 77.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.824 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.13 -46.54 89.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.405 -176.732 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 39' ' ' MET . 45.6 mtmt -65.46 -44.41 87.29 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.602 -179.151 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.3 mptt -61.92 -33.45 74.28 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 116.72 -0.218 . . . . 0.0 111.263 178.251 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 24.5 mm-40 -63.76 -49.83 71.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.9 mt -67.4 -49.43 71.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.439 -177.339 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 93.6 mtp -61.68 -44.91 96.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.497 -175.282 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.72 61.54 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.305 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -72.74 -51.03 20.87 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.32 0.581 . . . . 0.0 111.628 -177.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -87.04 -9.47 55.41 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -170.746 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt 76.66 67.06 0.05 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 124.683 1.193 . . . . 0.0 111.654 -179.787 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -104.12 129.48 51.83 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 173.684 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.57 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 23.9 ttmm -77.67 112.7 14.76 Favored 'General case' 0 N--CA 1.408 -2.573 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.256 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -0.9 30.27 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.079 -178.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.452 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -103.03 3.24 35.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.487 0.66 . . . . 0.0 109.297 178.849 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.57 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 23.0 t70 -118.59 -51.13 2.4 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.407 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.3 m -134.05 168.04 19.54 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.064 179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -113.6 169.47 8.95 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 -179.773 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.563 HD11 ' CG1' ' A' ' 77' ' ' VAL . 26.2 tp -116.78 125.32 51.44 Favored 'General case' 0 C--N 1.271 -2.832 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.953 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.567 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -115.99 136.5 52.98 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -179.576 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.468 HD12 HG22 ' A' ' 77' ' ' VAL . 39.0 mm -121.87 135.59 61.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -176.428 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.2 m -128.77 144.51 51.19 Favored 'General case' 0 C--O 1.196 -1.741 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 176.697 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.539 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.6 t-20 -72.95 138.43 46.11 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.737 -0.602 . . . . 0.0 109.869 179.679 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.86 -26.19 49.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.237 0.541 . . . . 0.0 111.015 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -94.69 -52.41 4.3 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.475 -176.245 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 p -90.88 -16.27 28.47 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.202 0.525 . . . . 0.0 110.47 -172.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 66.01 21.79 11.26 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.962 -179.522 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -83.61 130.92 34.99 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.417 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.25 143.94 33.29 Favored 'General case' 0 N--CA 1.416 -2.14 0 CA-C-O 121.024 0.44 . . . . 0.0 110.151 174.281 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 91.7 m-85 -103.92 99.06 8.82 Favored 'General case' 0 C--N 1.273 -2.74 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.04 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.2 p -91.32 -27.24 18.52 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.804 -173.863 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -101.34 143.58 31.21 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.5 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.3 p-10 -74.35 -11.07 60.15 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.733 0.301 . . . . 0.0 111.785 -177.454 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -3.46 58.83 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.703 178.281 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.86 58.66 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 174.543 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.54 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.52 137.74 52.36 Favored 'General case' 0 C--N 1.289 -2.051 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.338 -174.685 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.27 117.37 34.91 Favored Pre-proline 0 C--N 1.306 -1.303 0 C-N-CA 119.616 -0.833 . . . . 0.0 110.551 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 55.7 Cg_endo -76.86 152.76 32.62 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.374 2.716 . . . . 0.0 113.244 175.949 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.474 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 42.4 pttt -57.69 -22.2 44.84 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -86.95 -1.75 58.08 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 120.961 0.41 . . . . 0.0 111.756 -177.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -106.9 147.23 30.05 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 -178.424 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.4 p -109.13 124.39 50.73 Favored 'General case' 0 N--CA 1.424 -1.727 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 55' ' ' ASN . 15.9 m -123.39 149.98 27.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.569 0.7 . . . . 0.0 112.65 -177.44 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.6 mm -94.18 126.07 46.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 178.876 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.563 ' CG1' HD11 ' A' ' 51' ' ' LEU . 59.7 t -106.51 122.03 59.88 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -177.152 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -126.04 134.41 51.44 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.24 -173.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -90.27 116.78 28.5 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.419 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.77 150.52 48.54 Favored Pre-proline 0 C--N 1.308 -1.226 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.276 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.33 138.43 42.77 Favored 'Trans proline' 0 C--N 1.325 -0.668 0 C-N-CA 122.182 1.922 . . . . 0.0 111.876 -179.086 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.2 pt -73.82 -28.87 24.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.499 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.5 -86.64 0.66 Allowed Glycine 0 N--CA 1.41 -3.033 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -175.247 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -147.28 1.54 0.76 Allowed Glycine 0 N--CA 1.425 -2.048 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.748 179.478 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 8.1 m -77.84 86.46 0.98 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 122.388 1.089 . . . . 0.0 112.673 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm . . . . . 0 C--N 1.293 -1.88 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 178.505 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.495 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -83.28 99.16 0.85 Allowed 'Trans proline' 0 N--CA 1.437 -1.801 0 C-N-CA 122.089 1.859 . . . . 0.0 111.228 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 pp -96.44 7.75 45.74 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-O 122.051 0.929 . . . . 0.0 110.567 -179.179 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.23 -95.82 0.12 Allowed Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.795 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.7 m -125.84 98.76 5.67 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.028 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.6 mtp -63.98 137.26 57.92 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.785 -175.652 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 m -76.07 135.03 39.9 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.534 -179.173 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.9 p -149.6 145.29 26.7 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 119.681 -0.808 . . . . 0.0 110.896 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.0 t -107.02 128.74 61.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.341 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.444 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 21.6 m-70 -77.68 105.54 8.91 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 173.89 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.559 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 33.7 p90 -123.41 140.82 52.62 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -178.305 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -117.02 137.77 52.02 Favored 'General case' 0 C--N 1.286 -2.182 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 172.158 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.459 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 2.2 t80 -89.9 166.69 13.35 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -178.66 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.4 t -58.94 -31.5 68.74 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.627 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 m -84.6 -7.07 59.38 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.31 -179.982 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.459 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 95.6 mttt -116.87 124.38 49.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.422 0.629 . . . . 0.0 110.67 -177.12 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -81.93 -20.57 38.4 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.651 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -114.01 164.69 13.47 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.372 -0.831 . . . . 0.0 108.8 179.852 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -83.94 148.22 27.04 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 121.87 0.843 . . . . 0.0 111.601 -179.586 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.8 t0 -120.0 178.04 4.76 Favored 'General case' 0 C--N 1.279 -2.463 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -134.85 128.52 32.85 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 118.209 0.459 . . . . 0.0 110.07 -175.536 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.552 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.3 p -106.9 122.26 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.144 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.2 p -89.41 135.31 33.66 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -177.595 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.478 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.1 p90 -146.73 165.61 29.12 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -176.905 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -95.55 111.05 23.04 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 123.953 0.783 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.74 -174.17 20.26 Favored Glycine 0 C--N 1.298 -1.539 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 tt -95.27 -26.87 15.77 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 177.434 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.3 OUTLIER -143.31 151.76 40.88 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.465 178.699 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.5 tt -125.91 135.06 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.925 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.622 -177.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -62.17 141.75 58.01 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.383 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.557 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 52.1 tp -57.1 -43.22 82.03 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 123.502 0.721 . . . . 0.0 112.404 -175.616 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.532 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.4 t -56.45 -45.32 80.87 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.061 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -65.32 -42.06 93.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.376 179.616 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.61 -46.53 87.85 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 -179.48 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 44.7 mtmt -66.02 -40.43 91.07 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.248 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.89 -39.47 92.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.303 176.439 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -65.34 -50.72 64.54 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.629 177.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 75.7 mt -62.76 -48.29 88.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 123.562 0.539 . . . . 0.0 111.986 -177.554 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.6 mtm -64.72 -37.3 87.12 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.635 -178.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.91 64.14 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.188 -1.006 . . . . 0.0 111.36 177.182 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -63.51 -45.1 92.2 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.173 0.989 . . . . 0.0 111.658 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 31.7 mt-10 -103.39 3.33 35.01 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.907 -176.987 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.27 66.13 0.91 Allowed 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 124.614 1.166 . . . . 0.0 111.664 178.052 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.5 mp -98.69 135.09 40.69 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.597 177.553 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 39.4 ttmt -77.79 108.33 10.94 Favored 'General case' 0 N--CA 1.414 -2.247 0 CA-C-O 121.45 0.643 . . . . 0.0 109.951 179.143 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.55 1.67 25.02 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.16 179.263 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.429 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.17 -0.88 35.23 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.65 0.738 . . . . 0.0 109.852 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.5 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 12.2 t70 -115.68 -36.33 4.25 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.001 -1.0 . . . . 0.0 108.412 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 17.1 p -143.32 168.68 19.23 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.962 -174.938 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -116.12 169.38 9.31 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 177.67 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.531 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.4 tp -120.32 123.01 42.08 Favored 'General case' 0 C--N 1.259 -3.342 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 -178.401 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.576 ' HB2' HG12 ' A' ' 80' ' ' ILE . 41.9 tt0 -115.54 119.21 35.4 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -175.326 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.435 HG13 HG22 ' A' ' 77' ' ' VAL . 1.7 mp -105.87 132.56 52.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 CA-C-O 121.407 0.622 . . . . 0.0 111.032 -176.138 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.4 m -113.94 148.63 36.5 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.344 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.534 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -75.35 141.81 43.27 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 175.86 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.34 -28.33 42.04 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 0.0 110.989 -178.824 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -93.89 -53.33 4.04 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.384 -175.716 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -84.95 -22.47 29.19 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -174.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 65.57 23.07 11.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.408 -175.833 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.47 132.18 36.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.226 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -91.15 117.11 29.35 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-O 121.505 0.669 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -86.77 93.72 9.34 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.405 HG22 HE21 ' A' ' 52' ' ' GLN . 19.3 p -92.42 -10.01 39.56 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.492 -177.413 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.647 ' HB3' ' OD1' ' A' ' 66' ' ' ASN . 10.5 m-20 -101.73 132.09 47.64 Favored 'General case' 0 CA--C 1.479 -1.769 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.837 176.111 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.46 0.22 30.39 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.269 0.557 . . . . 0.0 111.666 -178.786 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.647 ' OD1' ' HB3' ' A' ' 64' ' ' ASP . 2.7 p-10 -90.66 1.8 56.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.797 178.337 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.31 154.47 40.94 Favored 'General case' 0 C--O 1.208 -1.091 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.685 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.45 137.39 53.2 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.68 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.42 116.68 33.44 Favored Pre-proline 0 C--N 1.302 -1.46 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.396 177.009 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -80.15 155.94 22.75 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.294 2.662 . . . . 0.0 113.75 176.559 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 13.6 ptmt -58.3 -21.43 49.01 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.825 178.084 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -87.11 -1.25 57.75 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 120.818 0.342 . . . . 0.0 111.6 -177.617 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.6 m -112.81 149.03 33.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.424 -178.48 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.4 p -109.39 132.49 54.08 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.9 m -132.03 160.76 42.24 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 121.405 0.621 . . . . 0.0 112.556 -177.544 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -108.53 125.57 65.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 179.71 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 51' ' ' LEU . 43.3 t -104.86 109.72 28.51 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-O 121.517 0.675 . . . . 0.0 109.759 -177.244 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -113.58 129.16 56.61 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.255 -175.435 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.579 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 56.5 ttp180 -91.6 129.87 37.5 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -179.213 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.576 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -130.38 153.3 81.28 Favored Pre-proline 0 C--N 1.309 -1.189 0 C-N-CA 121.116 -0.234 . . . . 0.0 110.413 -175.653 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.22 136.77 41.6 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 121.931 1.754 . . . . 0.0 111.122 178.103 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.7 pt -60.78 -31.74 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.915 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -91.52 14.25 64.42 Favored Glycine 0 N--CA 1.439 -1.124 0 C-N-CA 121.078 -0.582 . . . . 0.0 111.993 178.009 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -144.35 65.74 0.45 Allowed Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 178.929 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.415 ' HA ' HD13 ' A' ' 80' ' ' ILE . 40.0 t -81.26 87.18 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.675 0.75 . . . . 0.0 109.983 -177.335 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt . . . . . 0 N--CA 1.425 -1.704 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.354 -179.264 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 55.3 m . . . . . 0 N--CA 1.413 -2.32 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.551 ' SG ' HG22 ' A' ' 23' ' ' THR . 58.0 m -125.86 128.93 48.38 Favored 'General case' 0 C--N 1.291 -1.945 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.195 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' CE1' ' A' ' 24' ' ' PHE . 25.3 t -108.11 124.66 64.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.853 175.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -81.29 105.98 12.91 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.03 -0.987 . . . . 0.0 108.377 173.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.583 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.0 p90 -118.6 126.01 51.03 Favored 'General case' 0 C--N 1.278 -2.535 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.14 133.07 50.53 Favored 'General case' 0 C--N 1.278 -2.515 0 C-N-CA 118.536 -1.265 . . . . 0.0 107.688 176.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.402 ' HA ' ' HB ' ' A' ' 77' ' ' VAL . 1.0 OUTLIER -82.93 150.52 26.39 Favored 'General case' 0 C--N 1.282 -2.333 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 p -64.43 -24.79 67.75 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.43 0.633 . . . . 0.0 110.648 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 m -80.47 -15.59 56.39 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.861 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.443 ' HB3' ' OD1' ' A' ' 18' ' ' ASN . 82.3 mttt -104.44 157.78 16.93 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.82 0.819 . . . . 0.0 112.492 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -96.74 1.24 50.68 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.054 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.443 ' OD1' ' HB3' ' A' ' 16' ' ' LYS . 30.3 p-10 -145.6 164.91 30.25 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.787 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -91.82 139.4 30.71 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.04 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.17 177.62 4.75 Favored 'General case' 0 C--N 1.279 -2.46 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -144.26 120.83 11.08 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -172.198 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.431 HG13 ' CE1' ' A' ' 11' ' ' TYR . 1.9 m -95.23 126.83 47.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.551 HG22 ' SG ' ' A' ' 8' ' ' CYS . 10.8 p -98.93 118.19 35.15 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.471 ' CE1' HG23 ' A' ' 9' ' ' VAL . 43.4 p90 -131.46 175.59 9.02 Favored 'General case' 0 C--N 1.281 -2.394 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.624 -178.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -107.81 150.34 27.12 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.876 0.735 . . . . 0.0 109.799 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.41 -114.74 4.2 Favored Glycine 0 N--CA 1.42 -2.398 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tt -152.58 -41.08 0.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.541 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -133.49 152.63 51.93 Favored 'General case' 0 CA--C 1.49 -1.364 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.954 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -117.9 127.34 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.574 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.97 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.4 m -63.09 140.29 58.86 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 62' ' ' TYR . 59.5 tp -54.64 -39.23 67.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 124.64 1.176 . . . . 0.0 112.561 -175.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.679 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -54.38 -46.91 73.16 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -74.93 -36.86 62.15 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.821 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.9 -47.34 85.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.721 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.7 mtmt -71.69 -44.92 63.37 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.644 -178.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.679 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.2 mptt -61.38 -35.16 76.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.273 -0.422 . . . . 0.0 112.023 -178.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.39 -49.66 62.97 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 120.481 -0.488 . . . . 0.0 109.891 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -64.97 -42.33 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.971 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 57.4 mtt -59.78 -44.89 93.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.696 0.284 . . . . 0.0 111.237 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.07 -31.01 62.25 Favored Glycine 0 C--N 1.317 -0.491 0 CA-C-O 121.664 0.591 . . . . 0.0 112.058 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.7 ttt85 -69.32 -51.28 38.65 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 123.766 0.826 . . . . 0.0 111.646 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 40.0 mm-40 -92.98 -14.23 27.73 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -172.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp 77.75 72.3 0.06 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 125.657 1.583 . . . . 0.0 111.236 -177.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.9 mp -101.0 153.85 19.19 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.089 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.638 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.96 101.88 14.23 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.02 -12.56 59.69 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.443 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.39 -15.71 57.42 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.23 177.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -117.26 -31.31 5.34 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.588 0.709 . . . . 0.0 110.606 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.0 m -129.2 165.25 21.71 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-O 122.295 1.045 . . . . 0.0 113.787 -172.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.459 ' HB3' HD11 ' A' ' 80' ' ' ILE . 49.5 t0 -123.08 169.66 10.97 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 173.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 35' ' ' LYS . 14.2 tp -115.34 120.09 38.48 Favored 'General case' 0 C--N 1.257 -3.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.564 ' HB2' HG12 ' A' ' 80' ' ' ILE . 7.1 tp-100 -106.49 123.45 48.1 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-O 121.267 0.556 . . . . 0.0 109.604 -176.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 77' ' ' VAL . 19.8 mm -114.29 135.43 54.07 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -172.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.5 m -125.89 140.78 52.36 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.601 ' HA ' HG12 ' A' ' 75' ' ' VAL . 9.5 t-20 -72.55 138.22 46.76 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.28 -16.56 34.81 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.436 0.636 . . . . 0.0 110.723 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -99.17 -44.51 6.24 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.842 -173.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -100.38 -19.08 16.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.191 0.519 . . . . 0.0 110.254 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.9 mmmm 71.96 12.45 6.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.051 1.341 . . . . 0.0 112.155 -177.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.1 135.35 46.22 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.059 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -92.86 145.26 24.53 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.296 0.57 . . . . 0.0 110.544 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.432 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 82.3 m-85 -105.18 98.01 7.77 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -90.56 -37.67 13.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.435 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 11.6 t70 -101.17 150.59 22.79 Favored 'General case' 0 CA--C 1.495 -1.17 0 C-N-CA 120.482 -0.487 . . . . 0.0 109.831 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.606 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -64.32 -15.21 59.87 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.435 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -83.08 -11.17 58.25 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -62.19 141.19 58.32 Favored 'General case' 0 C--O 1.19 -2.038 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 -178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.541 HD13 ' CG ' ' A' ' 28' ' ' HIS . 2.8 pp -117.2 137.72 52.17 Favored 'General case' 0 C--N 1.289 -2.065 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.137 -171.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.34 112.53 43.76 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 48.8 Cg_endo -78.0 156.63 30.51 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 C-N-CA 122.803 2.335 . . . . 0.0 112.865 175.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 47.9 pttt -58.24 -17.5 19.7 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.429 0.692 . . . . 0.0 112.535 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -82.71 -1.95 52.8 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.918 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.436 ' HB3' HD21 ' A' ' 55' ' ' ASN . 35.1 m -115.46 118.61 33.67 Favored 'General case' 0 N--CA 1.424 -1.773 0 O-C-N 122.221 -0.3 . . . . 0.0 111.371 -177.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 m -89.8 123.21 33.58 Favored 'General case' 0 N--CA 1.425 -1.689 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.601 HG12 ' HA ' ' A' ' 55' ' ' ASN . 25.9 m -121.39 160.03 23.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 CA-C-O 120.945 0.402 . . . . 0.0 111.783 -172.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.7 mm -107.5 133.97 50.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 53' ' ' ILE . 57.3 t -106.44 117.75 52.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.444 -176.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -114.46 137.28 52.04 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -92.74 124.64 36.89 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.548 -0.72 . . . . 0.0 109.666 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.564 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -125.89 149.34 65.66 Favored Pre-proline 0 C--O 1.206 -1.202 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.144 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 C--N 1.32 -0.963 0 C-N-CA 122.297 1.998 . . . . 0.0 111.827 178.002 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 73.4 m . . . . . 0 N--CA 1.392 -3.372 0 CA-C-O 121.201 0.524 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.1 p -139.04 135.66 34.46 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.385 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.596 HG23 ' CE1' ' A' ' 24' ' ' PHE . 69.1 t -105.19 129.57 57.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -82.97 115.76 21.95 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.91 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.597 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 51.0 p90 -133.66 142.01 47.85 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -120.25 136.99 54.47 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 118.331 -1.348 . . . . 0.0 108.124 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -83.96 174.63 10.18 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -56.55 -37.31 70.35 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.157 0.583 . . . . 0.0 112.482 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.3 m -90.96 1.68 56.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.185 0.517 . . . . 0.0 111.498 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 1.4 mptm? -98.13 127.32 44.0 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.496 0.665 . . . . 0.0 111.615 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.8 tp -91.4 -21.65 20.87 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.964 -1.016 . . . . 0.0 108.341 175.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.22 149.11 46.76 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.011 -1.449 . . . . 0.0 108.954 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -78.16 147.2 34.64 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.422 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 28.4 m-20 -101.11 173.87 6.26 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.9 p -136.15 132.35 35.9 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -102.33 126.15 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 169.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.9 p -94.51 129.54 41.26 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.596 ' CE1' HG23 ' A' ' 9' ' ' VAL . 32.3 p90 -145.99 158.68 43.87 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -95.35 132.9 39.88 Favored 'General case' 0 C--N 1.296 -1.752 0 C-N-CA 119.994 -0.683 . . . . 0.0 111.072 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.92 -146.93 17.39 Favored Glycine 0 N--CA 1.437 -1.297 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.37 -41.95 2.58 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.5 OUTLIER -131.53 152.74 50.49 Favored 'General case' 0 CA--C 1.479 -1.764 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.264 177.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.529 ' HB ' ' CD2' ' A' ' 24' ' ' PHE . 12.4 tt -119.34 126.09 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.732 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.262 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.1 m -55.54 142.31 33.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.492 ' HG ' ' HE2' ' A' ' 35' ' ' LYS . 60.0 tp -58.36 -38.08 76.5 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.749 0.82 . . . . 0.0 112.309 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 35.6 t -56.18 -46.92 79.18 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 30.3 t70 -69.91 -37.89 76.11 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.291 -174.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.07 -46.53 67.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.781 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HE2' ' HG ' ' A' ' 31' ' ' LEU . 51.9 mtmt -66.03 -40.06 90.72 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.357 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -64.02 -35.2 79.93 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 123.552 0.532 . . . . 0.0 111.163 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 94.6 mt-30 -65.0 -47.21 78.33 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.65 -44.73 93.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.258 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 54.5 mtt -60.12 -43.83 95.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.673 0.273 . . . . 0.0 110.465 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -33.12 73.22 Favored Glycine 0 C--N 1.317 -0.525 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.54 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -70.97 -51.25 26.77 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.988 0.423 . . . . 0.0 111.186 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -84.57 -6.59 59.38 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.427 -172.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 7.6 mmmm 67.03 46.97 1.45 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 3.6 tp -83.3 115.61 22.06 Favored 'General case' 0 N--CA 1.411 -2.406 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.095 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.686 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.49 109.9 8.35 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-O 121.711 0.767 . . . . 0.0 110.289 177.432 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.31 58.16 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.787 -174.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.91 -1.71 57.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.556 0.694 . . . . 0.0 110.125 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.482 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 22.0 t70 -108.99 -51.65 2.86 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.794 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.7 m -140.01 164.62 29.53 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.446 0.641 . . . . 0.0 111.91 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -108.61 170.57 7.94 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' CG1' ' A' ' 77' ' ' VAL . 17.5 tp -118.58 112.5 19.95 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-O 121.334 0.588 . . . . 0.0 109.847 -172.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.449 ' HB2' HG12 ' A' ' 80' ' ' ILE . 19.0 tt0 -101.91 125.67 48.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.4 mm -113.21 132.7 61.32 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -126.39 141.24 51.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 122.338 -0.226 . . . . 0.0 110.43 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.519 ' HA ' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -59.52 124.24 19.43 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 122.856 0.462 . . . . 0.0 110.79 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.88 -28.91 64.89 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.79 -48.21 7.4 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.474 -0.785 . . . . 0.0 112.898 -175.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.9 p -103.83 -8.04 20.07 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.292 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 59.3 25.13 13.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.71 126.17 30.6 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -91.25 137.71 32.15 Favored 'General case' 0 C--N 1.287 -2.109 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -103.9 106.61 17.17 Favored 'General case' 0 C--N 1.278 -2.503 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.0 p -101.94 -17.9 15.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.021 -175.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.437 ' HB3' HD22 ' A' ' 66' ' ' ASN . 5.2 t70 -106.18 139.78 40.16 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.201 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.676 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -62.75 -16.48 57.93 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 122.886 0.474 . . . . 0.0 111.969 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.437 HD22 ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -77.37 -10.36 59.4 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.472 0.309 . . . . 0.0 111.479 -178.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.21 150.22 47.71 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.514 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.523 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -118.86 138.29 52.84 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 118.655 0.661 . . . . 0.0 111.225 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -121.19 117.17 30.73 Favored Pre-proline 0 C--N 1.316 -0.86 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.507 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 58.7 Cg_endo -76.67 154.89 35.13 Favored 'Trans proline' 0 C--N 1.332 -0.293 0 C-N-CA 123.148 2.565 . . . . 0.0 113.66 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.45 -8.61 55.94 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 122.092 0.949 . . . . 0.0 111.263 178.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -85.18 -1.67 57.16 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.527 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.8 m -119.81 174.58 6.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-O 121.427 0.632 . . . . 0.0 110.947 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.3 m -138.03 139.95 39.86 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 4.5 m -132.56 161.61 41.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 35.3 mm -106.36 131.84 55.06 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.504 ' CG1' HD11 ' A' ' 51' ' ' LEU . 49.7 t -105.06 117.22 50.34 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.198 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -119.71 121.27 38.84 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 121.569 0.7 . . . . 0.0 110.849 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -81.68 118.64 22.99 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.211 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.449 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.59 154.03 66.42 Favored Pre-proline 0 C--O 1.211 -0.946 0 N-CA-C 110.359 -0.237 . . . . 0.0 110.359 -176.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo . . . . . 0 C--N 1.331 -0.388 0 C-N-CA 122.364 2.043 . . . . 0.0 111.733 178.413 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 23' ' ' THR . 50.9 m . . . . . 0 N--CA 1.394 -3.249 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.6 p -140.43 136.82 33.44 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.093 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.588 HG23 ' CE1' ' A' ' 24' ' ' PHE . 68.9 t -105.84 128.48 60.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -78.32 113.96 16.79 Favored 'General case' 0 CA--C 1.484 -1.558 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.604 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.3 p90 -135.08 138.38 43.77 Favored 'General case' 0 C--N 1.277 -2.545 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -125.04 136.59 53.83 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 118.615 -1.234 . . . . 0.0 109.788 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.46 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -88.59 170.67 10.65 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 179.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.8 p -66.13 -15.68 63.32 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.303 0.573 . . . . 0.0 112.051 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.5 p -94.57 -11.85 28.65 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 123.215 0.606 . . . . 0.0 111.763 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 0.9 OUTLIER -102.73 133.25 48.09 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 120.9 0.381 . . . . 0.0 110.732 -175.171 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.19 -22.82 22.6 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -127.37 170.82 12.11 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -82.37 133.57 35.23 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.549 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 20.2 m-20 -83.98 175.88 9.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 171.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -143.09 116.07 8.84 Favored 'General case' 0 C--N 1.292 -1.912 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.146 -177.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -95.21 125.85 47.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.1 p -93.9 123.88 37.54 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-O 121.592 0.711 . . . . 0.0 112.783 -177.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.588 ' CE1' HG23 ' A' ' 9' ' ' VAL . 22.7 p90 -136.35 176.14 8.96 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -178.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.2 148.7 30.51 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.37 -113.15 3.6 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.785 176.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -148.5 -41.32 0.16 Allowed 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -137.33 155.36 49.51 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.95 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.5 tt -126.56 131.77 70.94 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.593 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.238 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 m -63.52 140.28 58.86 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 58.4 tp -55.65 -36.68 67.32 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.566 1.146 . . . . 0.0 112.443 -176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.724 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 18.7 t -54.13 -46.86 72.29 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 13.9 t70 -74.38 -37.82 63.33 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -175.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.4 tm? -58.39 -46.97 85.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.684 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -70.06 -39.88 75.4 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.983 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.724 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -65.11 -37.08 86.33 Favored 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.515 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 89.2 mt-30 -66.36 -45.37 80.39 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.09 -41.06 81.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.911 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.5 mtm -63.95 -37.27 86.79 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.425 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.52 -44.17 41.96 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 120.283 -0.96 . . . . 0.0 111.747 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 25.5 ttt180 -64.84 -49.41 70.68 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' OE2' ' HG2' ' A' ' 41' ' ' ARG . 23.1 mm-40 -92.65 12.99 21.34 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.669 0.271 . . . . 0.0 111.72 -173.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 57.34 47.44 16.64 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.292 1.037 . . . . 0.0 112.166 176.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD2' HD13 ' A' ' 51' ' ' LEU . 9.4 mp -81.81 160.89 23.42 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.975 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -96.96 112.43 24.19 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.62 -13.38 58.03 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.06 -13.71 22.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.727 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -113.84 -38.52 4.22 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 121.768 0.794 . . . . 0.0 110.73 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.01 174.63 7.47 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.66 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.43 166.41 17.25 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 53' ' ' ILE . 28.5 tp -121.85 113.72 20.04 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -111.59 123.61 50.59 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.976 -175.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.587 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.0 mp -113.41 127.36 70.76 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -173.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.448 ' OG1' ' HG2' ' A' ' 61' ' ' GLU . 29.8 m -122.22 134.57 54.7 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.559 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.1 t-20 -62.71 140.16 58.71 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -21.37 41.42 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.232 0.539 . . . . 0.0 111.68 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -101.14 -48.27 4.47 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.712 -176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.5 p -90.74 -20.04 22.86 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.355 0.597 . . . . 0.0 109.855 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.3 mmmt 64.14 24.1 13.35 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.585 1.154 . . . . 0.0 110.928 -177.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -80.52 125.01 29.43 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.448 ' HG2' ' OG1' ' A' ' 54' ' ' THR . 44.0 mt-10 -86.12 125.72 33.68 Favored 'General case' 0 N--CA 1.402 -2.839 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.78 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HB3' HD22 ' A' ' 31' ' ' LEU . 80.3 m-85 -89.48 94.74 9.99 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.014 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -88.7 -27.35 21.29 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.954 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.99 146.9 27.65 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.691 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.656 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -69.15 -14.33 62.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -81.6 -10.88 59.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.102 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.81 143.31 57.95 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.448 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.65 137.55 52.57 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 118.705 0.684 . . . . 0.0 110.762 -175.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.29 118.74 35.41 Favored Pre-proline 0 C--N 1.314 -0.958 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.006 176.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 80.4 Cg_endo -82.64 161.03 16.7 Favored 'Trans proline' 0 C--N 1.326 -0.651 0 C-N-CA 123.478 2.785 . . . . 0.0 113.66 176.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.505 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 40.2 pttt -70.05 -5.84 29.46 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.737 0.779 . . . . 0.0 111.203 175.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -87.65 -1.49 57.99 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.045 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -124.42 152.91 42.7 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.971 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.9 m -116.23 133.62 55.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.3 m -127.78 156.13 39.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.506 0.67 . . . . 0.0 112.406 -174.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -101.15 128.67 53.18 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 106.622 -1.621 . . . . 0.0 106.622 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.483 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.9 t -108.77 115.29 49.03 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -116.52 126.7 53.71 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.46 -174.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -89.82 111.53 22.58 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 pp -111.01 149.99 41.26 Favored Pre-proline 0 C--N 1.297 -1.711 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo . . . . . 0 C--N 1.316 -1.136 0 C-N-CA 121.724 1.616 . . . . 0.0 112.893 -179.319 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.593 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 38.6 m . . . . . 0 N--CA 1.412 -2.358 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 64.3 m -139.5 135.45 33.51 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.389 -174.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 21' ' ' THR . 77.5 t -106.82 132.07 55.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -88.1 115.21 25.42 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 46.0 p90 -130.02 130.9 45.55 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 pttp -109.32 139.22 44.55 Favored 'General case' 0 C--N 1.3 -1.577 0 C-N-CA 116.733 -1.987 . . . . 0.0 107.355 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -84.01 165.9 18.21 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.7 m -69.77 -16.99 63.4 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.325 0.583 . . . . 0.0 110.925 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 p -90.59 -13.06 35.2 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 121.367 0.603 . . . . 0.0 110.274 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -105.45 147.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.447 0.642 . . . . 0.0 111.31 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.7 mp -96.89 -30.79 12.93 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -105.89 163.22 12.91 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.394 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -86.89 142.97 27.64 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.363 0.601 . . . . 0.0 111.789 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -108.53 177.37 4.81 Favored 'General case' 0 C--N 1.288 -2.104 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.494 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -143.67 128.05 17.86 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -174.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 1.9 m -95.79 128.61 46.83 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 172.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.423 HG22 ' SG ' ' A' ' 8' ' ' CYS . 21.8 p -94.96 122.41 37.58 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.593 ' O ' ' HB2' ' A' ' 7' ' ' SER . 21.0 p90 -140.49 171.31 14.32 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -177.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -114.06 122.24 46.27 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.51 -172.32 23.07 Favored Glycine 0 N--CA 1.43 -1.709 0 N-CA-C 108.979 -1.648 . . . . 0.0 108.979 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -96.44 -33.52 11.85 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.173 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.538 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -146.06 151.52 37.86 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.119 -177.515 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -120.29 129.49 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.413 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.968 -178.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -60.96 142.22 56.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.971 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.454 HD22 ' HB3' ' A' ' 62' ' ' TYR . 56.3 tp -55.23 -40.58 71.03 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 124.734 1.214 . . . . 0.0 111.389 -177.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 65' ' ' ASP . 36.0 t -54.14 -46.44 72.23 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.528 0.518 . . . . 0.0 109.808 178.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.1 t70 -74.9 -41.05 60.48 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.861 -176.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -60.53 -44.18 96.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.175 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 51.0 mtmt -65.37 -38.62 90.6 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.436 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 6.0 mptp? -61.63 -37.93 85.78 Favored 'General case' 0 C--O 1.243 0.75 0 O-C-N 123.012 0.195 . . . . 0.0 110.859 177.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 67.6 mm-40 -67.22 -50.39 60.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.14 -43.76 84.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.133 -176.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.9 mtm -63.97 -39.51 94.3 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 122.273 -0.267 . . . . 0.0 111.047 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -42.28 74.23 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.386 177.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.61 -46.46 75.79 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -92.07 2.34 56.63 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt 65.33 53.55 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 124.946 1.298 . . . . 0.0 111.051 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.81 158.26 18.2 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.203 177.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -93.91 100.78 12.88 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-O 122.153 0.978 . . . . 0.0 109.172 175.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.31 60.33 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.991 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.42 -12.25 32.69 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.043 0.449 . . . . 0.0 111.447 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -105.45 -39.76 6.03 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.203 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.11 177.14 7.52 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.733 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.442 ' HB3' HD11 ' A' ' 80' ' ' ILE . 3.3 t70 -127.51 171.17 11.84 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 -178.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 18.2 tp -118.41 125.46 50.02 Favored 'General case' 0 C--N 1.275 -2.667 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.605 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.8 tt0 -114.02 121.94 45.39 Favored 'General case' 0 C--N 1.29 -2.0 0 O-C-N 121.831 -0.543 . . . . 0.0 110.216 -175.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.425 HG13 HG22 ' A' ' 77' ' ' VAL . 2.0 mp -114.08 127.64 71.4 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.977 0 CA-C-O 120.969 0.414 . . . . 0.0 110.809 -175.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.9 m -111.21 144.61 40.09 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.538 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.0 t-20 -80.85 131.39 35.38 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.55 -11.07 58.7 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 120.963 0.411 . . . . 0.0 111.456 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -105.92 -47.92 3.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.006 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.6 p -89.68 -19.19 25.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt 71.85 14.55 5.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.456 1.502 . . . . 0.0 110.678 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -80.68 131.33 35.45 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -95.11 126.75 40.66 Favored 'General case' 0 N--CA 1.408 -2.53 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.49 ' CD1' ' HB1' ' A' ' 67' ' ' ALA . 32.6 m-85 -90.51 101.93 14.66 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -177.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.9 p -101.01 -22.22 14.81 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.161 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.416 ' CG ' HD22 ' A' ' 66' ' ' ASN . 6.5 t70 -103.03 147.61 26.74 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -76.32 -7.83 55.79 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.416 HD22 ' CG ' ' A' ' 64' ' ' ASP . 0.8 OUTLIER -82.74 -10.91 58.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.49 ' HB1' ' CD1' ' A' ' 62' ' ' TYR . . . -62.2 141.46 58.18 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.12 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.538 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -117.53 138.42 51.91 Favored 'General case' 0 C--N 1.29 -2.018 0 O-C-N 121.908 -0.495 . . . . 0.0 111.437 -174.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.27 115.69 42.44 Favored Pre-proline 0 C--N 1.309 -1.162 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.441 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.51 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 54.7 Cg_endo -80.25 153.43 21.41 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.988 2.458 . . . . 0.0 113.592 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 16.1 ptmt -60.35 -20.27 58.79 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.852 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -75.31 -19.56 59.57 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.164 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.414 ' OG ' ' HG2' ' A' ' 70' ' ' PRO . 24.7 m -104.32 139.39 39.37 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-O 121.588 0.709 . . . . 0.0 112.455 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.3 m -97.89 129.38 44.83 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 171.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -123.95 164.39 22.11 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.5 mt -120.93 130.15 74.95 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 53' ' ' ILE . 23.1 t -102.27 124.39 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.772 -173.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -120.33 145.03 47.52 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.0 ttm105 -100.68 125.85 47.15 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.605 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -129.49 156.29 78.83 Favored Pre-proline 0 C--O 1.217 -0.639 0 C-N-CA 121.249 -0.18 . . . . 0.0 110.83 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo . . . . . 0 CA--C 1.537 0.626 0 C-N-CA 122.079 1.852 . . . . 0.0 110.318 175.537 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.6 m . . . . . 0 N--CA 1.407 -2.591 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.5 p -148.43 143.33 26.7 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.834 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.481 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.6 t -106.26 131.94 54.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -77.56 112.32 14.22 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 124.056 0.848 . . . . 0.0 108.749 174.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.637 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -132.31 141.47 48.98 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -120.54 142.46 49.31 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 117.77 -1.572 . . . . 0.0 108.473 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.555 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -84.5 157.38 21.32 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 176.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -55.58 -31.0 61.82 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.254 0.622 . . . . 0.0 112.601 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -122.43 16.63 10.51 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.123 0.487 . . . . 0.0 111.106 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 16.1 tptm -86.13 -29.03 23.61 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.6 tp 74.04 -52.78 0.69 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.102 1.761 . . . . 0.0 112.174 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -98.75 152.61 19.49 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.081 -178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -74.95 142.86 43.9 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.915 0.864 . . . . 0.0 112.274 -178.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -115.24 178.74 4.18 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -140.4 117.36 11.11 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 120.866 0.365 . . . . 0.0 110.289 -174.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 13.0 p -95.37 118.7 42.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.4 p -85.66 127.33 34.46 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.974 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 7' ' ' SER . 32.9 p90 -142.35 176.29 9.11 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -114.68 144.67 43.06 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.26 -179.14 19.8 Favored Glycine 0 C--N 1.306 -1.137 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -175.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -87.22 -33.36 19.35 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 118.03 0.915 . . . . 0.0 109.068 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.536 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -138.1 159.88 40.87 Favored 'General case' 0 CA--C 1.484 -1.576 0 CA-C-N 114.746 -1.116 . . . . 0.0 112.119 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.2 tt -128.28 128.53 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.098 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.536 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.6 m -62.66 147.03 50.65 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.256 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.73 -42.19 88.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 123.972 0.909 . . . . 0.0 112.697 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.586 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 33.7 t -56.5 -45.55 80.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.46 -45.78 82.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.909 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.36 -46.57 82.85 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.912 -176.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.8 mtmt -64.17 -41.18 97.24 Favored 'General case' 0 C--O 1.207 -1.139 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -62.94 -37.24 86.25 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -62.59 -50.62 70.54 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.025 0.441 . . . . 0.0 109.831 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.77 -47.8 68.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.87 -176.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.417 ' HG3' HD22 ' A' ' 51' ' ' LEU . 71.6 mtm -65.8 -33.59 76.21 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.43 35.71 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 119.211 -1.471 . . . . 0.0 111.16 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -59.63 -50.86 72.22 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.521 0.728 . . . . 0.0 111.931 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 7.7 mm-40 -92.72 0.22 57.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.266 0.555 . . . . 0.0 110.338 -174.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 60.75 70.93 0.59 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.69 1.196 . . . . 0.0 112.686 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.473 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.3 mp -103.97 144.2 31.84 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.526 -1.216 . . . . 0.0 108.899 175.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 7.0 ptpp? -92.9 103.49 15.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.972 0.892 . . . . 0.0 111.331 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.95 -16.48 62.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.43 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.04 1.75 51.88 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.308 0.575 . . . . 0.0 110.994 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 26.0 t70 -122.16 -36.72 2.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.608 0.718 . . . . 0.0 109.955 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -135.44 153.61 51.72 Favored 'General case' 0 N--CA 1.42 -1.951 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.717 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -108.6 159.92 16.34 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.6 tp -107.68 107.95 18.98 Favored 'General case' 0 C--N 1.267 -2.989 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HB2' HG12 ' A' ' 80' ' ' ILE . 31.8 tt0 -103.43 108.96 20.42 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.908 0.861 . . . . 0.0 109.123 -173.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.484 HD12 HG22 ' A' ' 77' ' ' VAL . 25.3 mm -94.56 135.42 28.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.314 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 24.3 m -118.8 149.33 41.69 Favored 'General case' 0 C--N 1.281 -2.4 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.502 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.7 t-20 -72.49 139.69 47.79 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.45 -26.25 51.3 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.144 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -92.74 -58.15 2.44 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.449 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.9 p -87.94 -16.61 33.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.152 0.501 . . . . 0.0 110.67 -171.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 63.71 21.79 12.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.091 0.956 . . . . 0.0 111.489 -177.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -75.46 130.4 38.86 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.1 mt-10 -87.44 137.49 32.29 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-O 121.097 0.475 . . . . 0.0 110.665 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -103.77 103.0 12.84 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -106.39 -19.96 13.53 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.922 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -90.21 133.62 34.8 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.502 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.5 m-20 -66.96 -13.25 61.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 120.801 0.334 . . . . 0.0 111.881 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -85.43 -6.19 59.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.32 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.28 141.77 58.64 Favored 'General case' 0 C--O 1.208 -1.117 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.536 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.96 137.63 52.71 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -177.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.72 115.45 35.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.278 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -77.71 155.85 31.28 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.042 2.495 . . . . 0.0 113.254 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 53.5 pttt -69.71 -8.14 45.3 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.536 0.684 . . . . 0.0 111.447 178.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -81.56 -17.7 47.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.383 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.5 m -105.71 158.72 16.52 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.879 -177.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 m -119.62 136.86 54.21 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.637 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -130.9 166.24 29.09 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 CA-C-O 121.078 0.466 . . . . 0.0 111.102 -175.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.5 mt -120.03 130.57 74.11 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.484 HG22 HD12 ' A' ' 53' ' ' ILE . 57.6 t -102.01 122.47 54.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.005 -173.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -127.51 128.13 45.16 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 47.6 ttp180 -88.1 125.85 34.8 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.495 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -122.68 142.18 36.98 Favored Pre-proline 0 N--CA 1.439 -0.988 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 C--N 1.31 -1.481 0 C-N-CA 122.261 1.974 . . . . 0.0 110.847 178.154 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.8 m . . . . . 0 N--CA 1.403 -2.795 0 CA-C-O 120.983 0.42 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 14.5 p -146.37 140.19 26.18 Favored 'General case' 0 N--CA 1.418 -2.043 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.513 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.537 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.9 t -107.74 124.66 63.98 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.256 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -73.62 105.35 4.91 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 124.203 0.939 . . . . 0.0 108.893 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -124.97 133.39 53.03 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -108.31 134.73 50.73 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 117.205 -1.798 . . . . 0.0 108.283 174.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 1.2 t80 -97.88 161.79 13.56 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.161 -2.162 . . . . 0.0 105.161 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 t -59.71 -26.29 65.5 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 t -87.86 -12.0 46.12 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.175 0.512 . . . . 0.0 110.833 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 2.8 mptp? -96.18 133.09 40.91 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 177.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.68 -22.76 25.89 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.3 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.505 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 18.7 m120 -120.42 168.62 11.12 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.572 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -76.5 144.67 39.64 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.644 0.735 . . . . 0.0 112.122 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -104.85 177.88 4.72 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -141.77 113.68 7.96 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 118.716 0.689 . . . . 0.0 112.006 -174.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.61 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.16 136.61 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.9 p -108.24 145.47 34.26 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -174.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.537 ' HE1' HG23 ' A' ' 9' ' ' VAL . 30.1 p90 -158.71 157.36 31.63 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.12 115.35 28.84 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 118.224 0.465 . . . . 0.0 109.78 175.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.23 175.6 14.97 Favored Glycine 0 C--N 1.284 -2.345 0 N-CA-C 108.205 -1.958 . . . . 0.0 108.205 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.0 tp -85.43 -32.86 22.1 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 118.409 1.105 . . . . 0.0 110.774 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -145.5 151.24 37.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -177.247 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.9 131.37 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.039 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.622 -177.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.1 m -61.84 148.05 44.55 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 123.122 0.569 . . . . 0.0 110.376 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 124.059 0.944 . . . . 0.0 111.394 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.63 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 49.5 t -55.59 -46.13 77.32 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -69.71 -44.33 70.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.261 0.553 . . . . 0.0 110.289 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.43 -45.82 89.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.09 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.0 mtmt -62.7 -42.96 99.91 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.922 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.3 mptp? -61.47 -35.44 77.64 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 120.753 0.311 . . . . 0.0 111.123 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -69.85 -42.71 73.19 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.455 ' O ' ' HB3' ' A' ' 41' ' ' ARG . 66.3 mt -74.34 -36.21 41.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.691 0.281 . . . . 0.0 111.444 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.505 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.5 mtt -62.45 -46.0 90.49 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.83 -38.67 93.16 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.258 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 25.8 tpt180 -54.62 -50.24 68.57 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.552 1.541 . . . . 0.0 110.925 178.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 67.1 mm-40 -100.58 6.29 44.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -176.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.407 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 63.96 36.23 10.21 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.591 0.756 . . . . 0.0 111.999 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.435 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.3 mp -66.74 154.05 41.72 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.599 0.714 . . . . 0.0 112.382 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 19.9 ptmt -98.44 106.88 19.22 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.652 173.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.83 -6.06 55.06 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.231 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.96 -5.5 59.23 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.904 177.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.508 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 17.9 t70 -128.88 -42.36 1.41 Allowed 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.511 0.672 . . . . 0.0 109.756 176.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.5 m -120.62 157.58 29.23 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -113.46 169.34 9.03 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' HD11 ' A' ' 53' ' ' ILE . 15.7 tp -119.62 113.41 20.65 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 119.756 -0.778 . . . . 0.0 108.953 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.627 HE21 HG21 ' A' ' 80' ' ' ILE . 9.3 tt0 -106.53 120.5 42.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.049 -177.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.471 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.1 mm -106.5 135.68 43.96 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.7 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 23.4 m -117.28 151.06 37.73 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 175.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.596 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -78.03 145.71 35.75 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 175.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.29 -21.86 24.2 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.304 0.573 . . . . 0.0 110.861 -178.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -96.75 -48.87 5.31 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.579 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 35.9 p -93.77 -21.89 19.03 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.02 0.438 . . . . 0.0 110.353 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 68.3 19.36 9.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.037 1.335 . . . . 0.0 112.139 -175.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.51 125.8 27.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.9 mt-10 -87.73 127.48 35.31 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.224 0.535 . . . . 0.0 110.785 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -93.04 100.95 13.28 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.0 p -99.19 -35.86 9.85 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.646 -176.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -85.88 135.71 33.59 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -66.8 -12.45 58.96 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -90.91 -1.42 57.84 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.867 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.92 148.29 51.77 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.62 137.63 53.14 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 118.393 0.542 . . . . 0.0 110.689 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -115.87 118.45 38.58 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.968 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.41 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 83.3 Cg_endo -83.62 157.5 14.18 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.097 2.532 . . . . 0.0 112.982 176.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.74 3.26 5.3 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 122.495 1.141 . . . . 0.0 110.78 176.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -87.68 -18.55 29.28 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.05 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.7 m -116.31 151.59 35.56 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.355 0.598 . . . . 0.0 111.74 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.2 t -105.96 137.63 43.53 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 176.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -128.46 159.65 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-O 121.648 0.737 . . . . 0.0 112.781 -177.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.3 mm -109.42 126.29 66.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.452 HG22 HD12 ' A' ' 53' ' ' ILE . 61.4 t -101.4 123.26 54.38 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.283 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 ttp-105 -122.94 124.48 43.29 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.225 0.536 . . . . 0.0 109.856 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -83.59 120.33 25.83 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.627 HG21 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -124.66 153.84 70.06 Favored Pre-proline 0 C--O 1.201 -1.471 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 CA--C 1.538 0.699 0 C-N-CA 122.07 1.847 . . . . 0.0 111.947 179.592 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' THR . 70.8 m . . . . . 0 N--CA 1.397 -3.099 0 CA-C-O 121.673 0.749 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.2 p -140.38 132.79 28.45 Favored 'General case' 0 N--CA 1.399 -3.023 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.04 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.595 HG23 ' HE1' ' A' ' 24' ' ' PHE . 43.5 t -107.11 127.96 62.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 62.7 m-70 -79.66 105.64 11.1 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 174.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.2 p90 -118.0 142.3 47.52 Favored 'General case' 0 C--N 1.28 -2.426 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -123.65 124.27 42.39 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 118.77 -1.172 . . . . 0.0 110.199 174.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -80.32 157.89 26.26 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 177.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 m -56.89 -37.68 71.72 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.042 0.448 . . . . 0.0 110.229 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 p -88.06 -8.59 55.32 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.43 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 31.5 tptt -83.37 -37.73 22.93 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 tt 73.65 -51.78 0.7 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 125.726 1.61 . . . . 0.0 109.571 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -100.18 170.01 8.75 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -88.2 155.66 19.64 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.22 0.533 . . . . 0.0 111.095 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.6 t70 -128.33 178.53 6.2 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -133.78 117.88 17.4 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 119.366 0.984 . . . . 0.0 112.258 -173.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.4 p -99.9 123.14 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.7 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 7' ' ' SER . 36.1 p -92.03 143.06 26.85 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.968 -177.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HE1' HG23 ' A' ' 9' ' ' VAL . 41.4 p90 -154.6 172.23 18.18 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.681 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.59 133.0 43.56 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.229 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.85 178.59 21.58 Favored Glycine 0 C--N 1.292 -1.915 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.03 -33.96 19.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -137.78 164.1 29.74 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.011 -179.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.0 tt -134.1 131.08 55.44 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.548 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m -63.58 143.16 58.06 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.9 tp -54.54 -40.08 68.32 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.27 1.428 . . . . 0.0 113.351 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.533 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.5 t -55.96 -45.89 78.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.719 0.295 . . . . 0.0 110.539 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.88 -41.73 70.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.26 -46.13 85.05 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.978 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.7 mtmt -61.73 -42.56 99.12 Favored 'General case' 0 C--O 1.206 -1.199 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.45 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.75 -35.11 77.15 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.27 0.356 . . . . 0.0 111.849 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -70.64 -45.68 64.72 Favored 'General case' 0 C--O 1.21 -1.009 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.109 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.4 -38.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.846 0.355 . . . . 0.0 111.348 -178.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.5 mtt -63.7 -38.99 93.2 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.6 -31.8 60.24 Favored Glycine 0 C--O 1.219 -0.833 0 N-CA-C 111.771 -0.531 . . . . 0.0 111.771 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.507 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 24.9 tpt180 -64.59 -51.36 63.15 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 124.818 1.247 . . . . 0.0 110.865 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -94.63 -17.95 21.82 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 80.4 70.14 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 125.811 1.645 . . . . 0.0 111.825 -176.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -97.55 165.93 11.75 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 114.803 -1.089 . . . . 0.0 111.793 176.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -107.19 101.79 11.16 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.235 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.77 -13.98 60.66 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.925 -173.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.52 2.38 56.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.721 0.772 . . . . 0.0 110.374 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -119.21 -36.26 3.42 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.742 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.3 p -139.22 162.48 34.89 Favored 'General case' 0 C--N 1.297 -1.695 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.806 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.405 ' HB3' HD11 ' A' ' 80' ' ' ILE . 40.4 t0 -114.6 166.58 11.58 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HG ' HD11 ' A' ' 53' ' ' ILE . 16.1 tp -117.33 105.54 12.28 Favored 'General case' 0 C--N 1.263 -3.153 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -174.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.439 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.6 tp60 -90.93 123.42 34.41 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 -175.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.427 HD11 ' HG ' ' A' ' 51' ' ' LEU . 27.8 mm -110.84 135.22 50.62 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.571 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.0 m -123.19 140.73 52.72 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.9 t-20 -71.52 139.68 49.62 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -29.66 55.88 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.631 0.729 . . . . 0.0 110.687 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -94.32 -49.64 5.62 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.127 -173.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.4 p -93.18 -18.23 22.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.291 0.567 . . . . 0.0 109.475 -175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 42.0 mmtm 65.15 22.55 12.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.603 1.161 . . . . 0.0 112.242 -177.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -78.06 129.26 35.02 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -83.73 136.89 34.0 Favored 'General case' 0 N--CA 1.412 -2.373 0 CA-C-O 121.336 0.588 . . . . 0.0 109.595 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.44 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 89.7 m-85 -96.13 98.73 10.57 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 3.2 p -91.8 -40.98 10.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -175.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -91.87 147.45 22.96 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 13.5 m-20 -66.06 -16.03 63.58 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.887 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -88.96 -1.33 58.05 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.201 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.44 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -66.42 145.4 55.72 Favored 'General case' 0 C--O 1.209 -1.076 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.06 137.73 52.71 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 119.928 -0.709 . . . . 0.0 112.696 -172.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.13 117.97 40.75 Favored Pre-proline 0 C--N 1.312 -1.024 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.87 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 64.4 Cg_endo -81.83 154.48 17.58 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.083 2.522 . . . . 0.0 112.827 174.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.557 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.17 -10.72 56.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -87.76 -2.05 58.36 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.319 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 55.2 m -106.92 140.0 40.42 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.302 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 m -100.0 131.67 45.82 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 172.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 55' ' ' ASN . 27.0 m -125.88 159.86 33.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -176.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 mm -105.07 135.34 43.5 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 45.5 t -111.73 117.66 55.67 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-O 120.973 0.416 . . . . 0.0 110.085 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -119.38 122.9 42.84 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.407 0.683 . . . . 0.0 109.993 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -77.97 121.6 24.41 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.439 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.37 146.72 45.55 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.867 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--N 1.313 -1.322 0 C-N-CA 122.344 2.029 . . . . 0.0 111.043 178.0 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.586 ' O ' ' HA ' ' A' ' 23' ' ' THR . 3.3 m . . . . . 0 N--CA 1.416 -2.142 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.3 p -138.11 134.17 34.31 Favored 'General case' 0 N--CA 1.419 -2.007 0 C-N-CA 119.542 -0.863 . . . . 0.0 111.855 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' CE1' ' A' ' 24' ' ' PHE . 74.5 t -106.67 125.59 62.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 175.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -77.82 119.75 21.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.658 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 43.1 p90 -133.98 138.55 45.51 Favored 'General case' 0 C--N 1.286 -2.176 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -118.46 146.12 44.73 Favored 'General case' 0 N--CA 1.426 -1.649 0 C-N-CA 118.433 -1.307 . . . . 0.0 107.678 173.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -92.87 169.4 10.49 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -63.7 -16.68 61.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.901 0.857 . . . . 0.0 110.708 174.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.0 m -138.15 107.85 6.25 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 171.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -177.81 -39.23 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.0 tp 76.71 -52.53 0.58 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.905 1.682 . . . . 0.0 111.136 -178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -102.01 172.65 6.79 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -94.99 143.38 26.52 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-O 121.24 0.543 . . . . 0.0 109.672 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -104.6 177.76 4.75 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 175.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.13 116.29 9.44 Favored 'General case' 0 C--N 1.275 -2.642 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -173.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 15.0 p -95.16 116.94 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.782 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.586 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.2 p -89.42 124.36 34.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.587 0.708 . . . . 0.0 112.201 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.461 ' CE1' HG23 ' A' ' 9' ' ' VAL . 31.6 p90 -132.92 177.17 7.86 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -176.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -113.8 136.1 53.23 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.95 174.48 17.17 Favored Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -82.12 -35.58 28.38 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.503 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -135.08 159.24 42.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -179.753 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.4 tt -127.4 126.14 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.572 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.0 m -59.74 141.36 55.35 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.957 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.459 HD11 ' CG1' ' A' ' 53' ' ' ILE . 56.8 tp -55.24 -40.91 71.43 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 123.973 0.909 . . . . 0.0 112.045 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.734 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 9.3 t -56.3 -46.66 79.71 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.8 t70 -68.05 -43.92 77.57 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 -177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.22 -46.61 89.71 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.883 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 44.2 mtmt -67.13 -40.48 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.707 0.289 . . . . 0.0 110.645 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.3 mptt -65.03 -34.09 77.61 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.093 178.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.6 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 83.2 mm-40 -62.13 -49.95 73.84 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.353 0.596 . . . . 0.0 109.495 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.3 mt -67.76 -47.85 78.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.627 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.1 mtm -63.33 -37.24 86.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.853 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.43 61.89 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.154 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -72.39 -49.55 33.01 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 122.628 0.371 . . . . 0.0 111.548 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 44.2 mt-10 -93.45 -1.74 55.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 18.9 mmtp 71.75 45.02 0.45 Allowed 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.411 1.085 . . . . 0.0 111.225 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.7 mp -73.34 162.99 28.71 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.942 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.46 100.28 12.86 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.133 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.07 -14.73 58.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.887 -173.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.68 -4.39 23.83 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.878 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -103.1 -42.55 5.74 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.972 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.4 m -133.65 166.17 23.24 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.7 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -108.13 162.14 14.33 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.524 HD11 ' CG1' ' A' ' 77' ' ' VAL . 33.1 tp -107.44 125.05 50.75 Favored 'General case' 0 C--N 1.251 -3.674 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.603 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.2 tt0 -110.67 128.93 55.91 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 -178.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.7 mm -113.31 133.62 58.62 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -176.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 22.8 m -116.71 153.39 32.46 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 176.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -83.86 146.51 28.05 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.08 -12.45 28.48 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.267 0.556 . . . . 0.0 111.187 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -103.76 -39.64 6.58 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.096 -176.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -100.04 -25.11 14.42 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.8 mmmm 68.84 24.93 6.33 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.099 1.359 . . . . 0.0 111.131 -176.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -90.24 135.51 33.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.731 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 18.4 mp0 -78.81 141.53 37.67 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 121.043 0.449 . . . . 0.0 110.959 175.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -103.21 99.4 9.25 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 173.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 p -82.22 -31.18 30.42 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' HD23 ' A' ' 31' ' ' LEU . 2.2 m-20 -105.87 139.42 40.46 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.608 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -63.19 -7.25 5.51 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.066 0.946 . . . . 0.0 111.454 178.179 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -90.63 -0.16 57.59 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.368 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.04 152.05 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.503 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.76 137.35 53.42 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 118.21 0.459 . . . . 0.0 110.36 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -116.34 117.3 38.75 Favored Pre-proline 0 C--N 1.304 -1.386 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.652 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.7 Cg_endo -79.77 159.7 24.72 Favored 'Trans proline' 0 C--N 1.323 -0.779 0 C-N-CA 122.936 2.424 . . . . 0.0 112.683 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.1 pttt -70.59 1.01 5.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.486 0.66 . . . . 0.0 111.327 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -87.81 -11.26 48.49 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.8 m -122.21 149.35 43.79 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 121.389 0.614 . . . . 0.0 112.56 -172.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 m -103.43 133.28 48.75 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 19.2 m -126.25 169.78 17.18 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 CA-C-O 120.924 0.392 . . . . 0.0 111.026 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mt -123.95 136.11 61.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 123.704 0.802 . . . . 0.0 109.012 -177.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.524 ' CG1' HD11 ' A' ' 51' ' ' LEU . 26.3 t -106.23 128.58 60.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.472 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -136.73 133.4 36.04 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -89.62 132.42 35.13 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.603 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -131.44 152.65 80.85 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 118.215 0.461 . . . . 0.0 110.318 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo . . . . . 0 C--O 1.242 0.72 0 C-N-CA 121.795 1.663 . . . . 0.0 110.875 177.184 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HA ' ' A' ' 23' ' ' THR . 41.9 m . . . . . 0 N--CA 1.415 -2.196 0 CA-C-O 120.78 0.324 . . . . 0.0 111.797 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.608 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.1 p -148.53 135.19 19.78 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.357 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.584 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.3 t -107.06 134.43 48.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -84.0 109.68 17.83 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -127.82 138.97 52.9 Favored 'General case' 0 C--N 1.277 -2.555 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -121.03 137.52 54.61 Favored 'General case' 0 C--N 1.281 -2.398 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.4 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.5 t80 -90.42 156.77 17.98 Favored 'General case' 0 C--N 1.283 -2.29 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.6 m -56.92 -29.19 62.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.899 0.381 . . . . 0.0 111.007 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.6 m -83.76 -10.96 57.74 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.311 0.644 . . . . 0.0 111.813 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -101.19 156.98 17.11 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 122.107 -0.37 . . . . 0.0 110.873 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.9 mt -97.56 -43.24 7.31 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.736 0.779 . . . . 0.0 108.949 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -114.54 167.64 10.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.394 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -76.12 149.1 37.44 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.948 0.88 . . . . 0.0 112.779 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -112.16 177.11 4.75 Favored 'General case' 0 C--N 1.28 -2.441 0 N-CA-C 105.126 -2.175 . . . . 0.0 105.126 174.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -140.18 113.53 8.49 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 118.612 0.642 . . . . 0.0 110.354 -174.035 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 12.2 p -96.3 124.07 48.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.402 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.527 ' HA ' ' O ' ' A' ' 7' ' ' SER . 13.3 p -87.3 140.07 29.92 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.648 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.584 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.0 p90 -148.08 167.36 25.18 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 120.987 0.423 . . . . 0.0 110.736 -178.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -101.63 116.15 32.1 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.611 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.42 177.07 15.46 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 110.435 -1.066 . . . . 0.0 110.435 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.3 tp -77.52 -30.98 53.14 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 122.021 0.915 . . . . 0.0 109.529 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.61 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.76 158.72 43.46 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.533 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 tt -124.53 128.1 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.103 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 m -62.1 142.3 57.65 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.944 175.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 58.2 tp -54.41 -39.87 67.71 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 125.301 1.441 . . . . 0.0 112.262 -176.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.557 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -55.83 -46.19 78.18 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 123.24 0.337 . . . . 0.0 110.602 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.1 t70 -73.34 -39.08 65.49 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -175.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.76 -46.19 89.19 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.05 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 53.4 mtmt -66.32 -39.76 89.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.0 mptp? -61.71 -40.35 94.72 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.275 178.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 64.6 mt-30 -66.9 -50.32 62.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.445 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.72 -43.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.631 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.55 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 71.1 mtm -64.27 -45.07 89.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.74 -178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.38 -33.89 61.09 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.965 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 41' ' ' ARG . 35.3 ttt180 -75.09 -46.75 32.56 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 32.2 mm-40 -94.24 13.13 24.36 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp 68.16 34.04 4.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.518 1.127 . . . . 0.0 111.873 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 10.5 mp -74.62 174.19 9.39 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.172 0.987 . . . . 0.0 112.819 -178.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.613 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 13.2 ptpt -109.82 108.28 18.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.618 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.37 -20.71 31.52 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -175.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -107.04 -15.13 14.76 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.947 0.403 . . . . 0.0 111.343 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.613 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 14.4 t70 -92.56 -27.66 17.23 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -176.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -147.94 167.51 24.66 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -110.87 169.5 8.72 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.472 HD11 HG12 ' A' ' 77' ' ' VAL . 31.2 tp -127.52 119.78 26.8 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -175.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HB2' HG12 ' A' ' 80' ' ' ILE . 39.4 tt0 -121.63 136.98 54.92 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -115.39 135.62 54.79 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.904 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -176.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 m -121.51 146.03 47.35 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.541 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -74.64 137.22 42.1 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.77 43.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.364 0.602 . . . . 0.0 111.205 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -100.06 -52.84 3.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.929 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.3 p -92.23 -16.59 25.97 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.6 mmmm 68.41 17.13 9.19 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.749 1.219 . . . . 0.0 111.463 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -81.4 132.42 35.32 Favored 'General case' 0 N--CA 1.433 -1.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -83.85 146.71 27.95 Favored 'General case' 0 N--CA 1.415 -2.195 0 CA-C-O 121.577 0.703 . . . . 0.0 110.416 178.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 79.7 m-85 -107.22 103.83 13.3 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -100.38 -36.99 9.04 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -88.61 140.01 29.89 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.546 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 2.0 m-20 -68.61 -10.79 58.17 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -88.83 -4.45 58.49 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.035 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.424 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -63.73 142.89 58.24 Favored 'General case' 0 C--O 1.208 -1.095 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.61 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -117.14 137.79 52.08 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.586 -173.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.62 117.87 37.54 Favored Pre-proline 0 C--N 1.306 -1.323 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 91.2 Cg_endo -81.3 160.22 20.09 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 123.233 2.622 . . . . 0.0 114.063 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -67.96 -9.19 43.37 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.889 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -87.91 -1.57 58.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.423 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.9 m -121.01 157.34 30.2 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 121.406 0.622 . . . . 0.0 112.233 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 m -115.06 130.83 57.03 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 174.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.4 m -127.26 160.22 36.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.46 0.647 . . . . 0.0 112.694 -175.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.4 mm -104.0 123.86 58.01 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 51' ' ' LEU . 40.6 t -104.43 120.12 54.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -127.13 130.51 49.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.239 -172.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -83.52 120.93 26.54 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.63 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -117.59 156.62 49.22 Favored Pre-proline 0 C--N 1.313 -0.985 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.735 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 26.0 Cg_endo . . . . . 0 N--CA 1.453 -0.86 0 C-N-CA 122.231 1.954 . . . . 0.0 112.798 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.669 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 50.3 m . . . . . 0 N--CA 1.422 -1.845 0 CA-C-O 121.28 0.562 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.0 p -132.95 135.72 45.69 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.85 -177.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG23 ' HE1' ' A' ' 24' ' ' PHE . 40.8 t -110.29 126.61 67.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -82.4 111.34 18.36 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.635 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.2 p90 -127.36 139.91 52.54 Favored 'General case' 0 C--N 1.28 -2.44 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -123.1 139.28 54.24 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.001 -1.48 . . . . 0.0 107.876 174.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -78.7 171.23 15.45 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -57.77 -37.54 73.85 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 123.28 0.632 . . . . 0.0 111.867 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.7 m -102.22 9.78 39.79 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-O 121.067 0.46 . . . . 0.0 111.918 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -92.71 135.19 34.32 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.2 mt -96.79 -24.12 16.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.428 0.632 . . . . 0.0 109.796 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -107.13 165.18 11.55 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -92.63 138.59 31.37 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.289 0.566 . . . . 0.0 110.219 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 173.24 7.79 Favored 'General case' 0 C--N 1.281 -2.37 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 175.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.51 128.95 30.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -111.86 138.89 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.222 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 176.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -116.7 143.84 45.15 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.1 p90 -153.7 176.81 11.68 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -125.81 130.56 51.65 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.403 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.34 -114.63 1.19 Allowed Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -140.9 -45.75 0.39 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.593 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -141.5 158.45 43.83 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -177.36 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -125.43 129.78 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.289 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -63.86 149.52 46.85 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 122.881 0.472 . . . . 0.0 110.471 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 43.2 tp -57.61 -44.75 85.7 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.544 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 50.4 t -56.64 -45.51 81.53 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.953 177.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.96 -42.31 94.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.416 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -62.67 -47.47 83.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.267 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.6 mtmt -67.21 -41.82 85.13 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.275 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -61.7 -35.18 77.3 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -69.1 -49.15 59.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 0.0 110.546 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.2 mt -69.56 -44.09 79.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.311 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.461 ' HG2' HD22 ' A' ' 44' ' ' LEU . 72.3 mtm -62.94 -37.34 86.66 Favored 'General case' 0 CA--C 1.51 -0.591 0 O-C-N 122.23 -0.294 . . . . 0.0 111.34 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.94 -41.58 87.52 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -66.89 -38.07 85.59 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 123.079 0.551 . . . . 0.0 112.119 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.96 11.87 37.83 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.967 0.413 . . . . 0.0 111.158 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? 59.34 38.36 23.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.513 172.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.461 HD22 ' HG2' ' A' ' 39' ' ' MET . 9.2 mp -73.13 152.91 40.98 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -83.85 100.48 10.99 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.36 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.41 -8.3 59.41 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.195 -173.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 6.69 42.59 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.155 0.503 . . . . 0.0 109.993 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -130.23 -40.84 1.28 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.403 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.78 172.54 9.23 Favored 'General case' 0 N--CA 1.418 -2.059 0 CA-C-O 121.552 0.691 . . . . 0.0 111.241 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -126.3 166.74 16.57 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.9 tp -111.32 118.29 35.48 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.503 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.4 tp60 -104.51 126.13 51.31 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.422 HD12 HG22 ' A' ' 77' ' ' VAL . 30.3 mm -108.92 135.23 48.44 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -176.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.7 m -127.17 136.68 52.41 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.531 ' HA ' HG12 ' A' ' 75' ' ' VAL . 12.3 t-20 -64.97 135.09 55.25 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 117.892 0.314 . . . . 0.0 110.3 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.9 -23.26 58.34 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.228 0.537 . . . . 0.0 110.786 -178.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -94.98 -55.81 2.96 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.874 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -92.72 -15.78 26.26 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.891 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.95 21.23 12.54 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.537 0.735 . . . . 0.0 112.458 -174.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -71.96 117.86 14.1 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -81.52 138.91 35.4 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.07 96.98 7.59 Favored 'General case' 0 C--N 1.274 -2.712 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.2 p -94.59 -20.02 19.98 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.742 -175.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.64 129.46 45.78 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.574 -174.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -71.22 -7.59 47.86 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.709 0.686 . . . . 0.0 112.191 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -93.07 2.15 56.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.27 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.31 147.64 49.41 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 175.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.593 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.54 138.35 51.96 Favored 'General case' 0 C--N 1.28 -2.428 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.685 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -113.96 114.33 46.47 Favored Pre-proline 0 C--N 1.307 -1.279 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.858 175.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.518 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.3 Cg_endo -77.75 161.28 30.68 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.097 2.532 . . . . 0.0 112.806 175.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.669 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 19.9 pttm -66.92 -8.86 32.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.789 0.804 . . . . 0.0 111.219 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.61 -3.22 58.98 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.497 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.2 m -114.72 125.48 53.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 120.903 0.382 . . . . 0.0 111.404 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.0 m -90.26 123.58 34.16 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 23.6 m -123.54 155.12 29.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.431 0.634 . . . . 0.0 112.598 -175.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.26 132.23 48.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.495 ' CG1' HD11 ' A' ' 51' ' ' LEU . 70.5 t -105.93 125.46 61.43 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.577 -176.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -131.42 145.24 51.71 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 ttp85 -99.96 126.29 46.1 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 122.051 -0.406 . . . . 0.0 109.987 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.66 155.61 66.0 Favored Pre-proline 0 C--N 1.314 -0.976 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -178.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 CA--C 1.545 1.05 0 C-N-CA 122.316 2.01 . . . . 0.0 111.94 177.064 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 N--CA 1.409 -2.482 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 18.3 p -124.07 135.42 53.55 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.437 -175.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.0 t -107.93 124.77 64.34 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.42 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 80.2 m-70 -78.04 110.59 13.12 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.518 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 31.0 p90 -128.47 141.37 51.41 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -177.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HE3' HD12 ' A' ' 76' ' ' ILE . 18.6 pttp -117.11 130.94 56.97 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.341 -1.344 . . . . 0.0 107.894 172.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.9 t80 -85.03 163.44 18.85 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.526 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 11.5 m -56.9 -24.99 56.09 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 123.398 0.679 . . . . 0.0 111.515 175.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.5 m -94.9 -8.58 36.72 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.537 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -112.22 124.46 52.5 Favored 'General case' 0 CA--C 1.506 -0.728 0 O-C-N 121.869 -0.519 . . . . 0.0 110.348 -176.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mp -88.92 -4.87 58.33 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.509 0.671 . . . . 0.0 110.43 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -122.22 167.43 13.22 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -91.02 143.7 26.43 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.591 0.71 . . . . 0.0 112.321 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.6 t70 -111.83 177.88 4.5 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -140.21 117.45 11.29 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 118.21 0.459 . . . . 0.0 110.951 -174.435 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.6 142.07 14.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.8 p -116.29 133.26 56.21 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -174.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.532 ' HE1' HG23 ' A' ' 9' ' ' VAL . 28.2 p90 -143.12 177.03 8.67 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.602 1.161 . . . . 0.0 107.927 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -120.62 128.35 52.94 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.01 -114.03 1.04 Allowed Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.509 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -145.02 -42.45 0.23 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.527 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.08 153.36 42.1 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.4 tt -121.53 132.42 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.852 -178.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.44 ' HB2' ' OD1' ' A' ' 33' ' ' ASP . 37.5 m -64.75 146.52 54.68 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.03 176.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 50.6 tp -57.58 -43.34 84.51 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 124.528 1.131 . . . . 0.0 113.257 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.604 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 37.4 t -56.88 -45.83 82.26 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB2' ' A' ' 30' ' ' SER . 9.0 m-20 -63.38 -47.46 81.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.663 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.56 -47.47 84.13 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.521 1.128 . . . . 0.0 110.708 -176.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.7 mtmt -69.35 -43.48 73.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.952 -178.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.604 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.9 mptp? -61.85 -39.38 91.65 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 90.8 mt-30 -64.99 -50.57 65.81 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.7 mt -63.91 -47.54 90.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.884 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.95 -33.61 76.45 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.268 -178.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.66 -43.23 36.88 Favored Glycine 0 C--N 1.312 -0.797 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.268 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -59.52 -42.46 92.29 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 125.093 1.357 . . . . 0.0 111.838 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.429 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 33.6 mt-10 -104.05 8.92 36.63 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.043 -175.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.72 64.23 1.35 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.277 175.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.445 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 10.4 mp -99.73 -176.36 3.24 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.896 177.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 18.5 ptpt -107.47 100.62 10.03 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.88 0.848 . . . . 0.0 110.423 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.56 -18.33 38.7 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.719 -176.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.63 9.21 35.73 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.908 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.459 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 23.8 t70 -133.36 -47.2 0.83 Allowed 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.762 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.9 m -112.63 176.95 4.8 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.892 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.439 ' HB3' ' CD1' ' A' ' 80' ' ' ILE . 37.2 t70 -124.09 163.08 22.21 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.3 tp -118.5 108.96 15.64 Favored 'General case' 0 N--CA 1.397 -3.104 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.3 tp-100 -91.39 120.81 32.57 Favored 'General case' 0 C--N 1.284 -2.255 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.454 HD11 ' HG ' ' A' ' 51' ' ' LEU . 35.2 mm -110.8 127.87 67.58 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.038 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -174.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 m -122.32 140.02 53.14 Favored 'General case' 0 C--N 1.268 -2.946 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.5 t-20 -65.37 131.83 47.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.87 -30.77 70.22 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.284 0.564 . . . . 0.0 110.746 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -91.48 -58.28 2.49 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.161 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.7 p -85.66 -14.94 43.99 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.038 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm 65.25 20.54 11.92 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.045 0.938 . . . . 0.0 111.685 -177.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.82 119.75 14.52 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.957 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -85.39 138.25 32.4 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-O 121.309 0.576 . . . . 0.0 109.92 177.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -100.61 90.42 4.26 Favored 'General case' 0 C--N 1.278 -2.504 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -82.48 -39.61 22.24 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.073 -175.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.693 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 6.8 m-20 -85.53 138.73 32.0 Favored 'General case' 0 CA--C 1.482 -1.638 0 CA-C-N 116.717 -0.219 . . . . 0.0 110.873 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.7 m-20 -66.57 -12.37 57.5 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.267 0.556 . . . . 0.0 111.239 -177.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.693 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 8.7 p30 -92.87 1.01 57.51 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.43 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.86 151.64 46.32 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -118.71 138.02 52.93 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 118.137 0.426 . . . . 0.0 111.384 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.92 115.93 43.11 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.927 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 48.6 Cg_endo -75.67 153.61 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.867 2.378 . . . . 0.0 113.472 175.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HA ' HG22 ' A' ' 9' ' ' VAL . 18.0 pttp -63.67 -18.22 63.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.561 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -85.53 -4.93 59.31 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.655 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 43.5 m -116.88 139.29 50.8 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 120.906 0.384 . . . . 0.0 111.188 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 t -96.53 135.67 38.1 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -128.82 157.0 41.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 CA-C-O 121.251 0.548 . . . . 0.0 111.693 -177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 ' HE3' ' A' ' 12' ' ' LYS . 31.3 mm -102.04 132.69 47.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 11' ' ' TYR . 54.4 t -110.33 107.23 22.38 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.144 0 CA-C-O 121.442 0.639 . . . . 0.0 110.145 -175.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.526 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 12.0 tpt180 -110.34 123.7 50.33 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.199 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -81.66 122.62 27.86 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 176.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.662 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -125.81 156.59 71.04 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 120.477 0.179 . . . . 0.0 110.779 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo . . . . . 0 CA--C 1.546 1.103 0 C-N-CA 122.378 2.052 . . . . 0.0 111.11 175.818 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.605 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.1 m . . . . . 0 N--CA 1.428 -1.572 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.9 p -137.93 140.45 40.3 Favored 'General case' 0 N--CA 1.419 -2.0 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.694 -176.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.416 HG23 ' CE1' ' A' ' 24' ' ' PHE . 77.3 t -106.78 124.69 62.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -79.78 114.61 18.84 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 175.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.0 p90 -130.36 141.16 50.58 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -130.56 136.83 49.3 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.57 173.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -86.08 165.67 16.45 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -175.754 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -58.51 -31.61 68.06 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.845 0.831 . . . . 0.0 108.957 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 m -84.32 -13.65 51.83 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 114.9 -1.045 . . . . 0.0 112.049 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.488 ' HD2' ' OE1' ' A' ' 42' ' ' GLU . 54.6 mtpt -116.08 126.46 53.78 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 121.885 -0.509 . . . . 0.0 111.252 -173.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.45 -41.01 48.93 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.086 -0.507 . . . . 0.0 112.063 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -104.86 159.56 15.7 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.031 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -77.29 136.96 38.53 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 121.341 0.591 . . . . 0.0 111.982 -177.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.407 ' HB3' ' CE1' ' A' ' 11' ' ' TYR . 6.1 t70 -100.24 172.83 6.92 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.1 p -138.29 122.53 18.14 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -94.37 113.63 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 7' ' ' SER . 6.1 p -88.14 111.18 21.31 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.301 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.9 p90 -128.17 154.8 45.39 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -96.23 101.58 13.25 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.681 0.753 . . . . 0.0 109.675 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 157.49 -174.32 34.94 Favored Glycine 0 C--N 1.287 -2.162 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.64 -42.53 7.21 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.19 150.74 47.05 Favored 'General case' 0 CA--C 1.484 -1.596 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.75 179.788 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -120.65 129.39 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.4 0 CA-C-N 115.025 -0.988 . . . . 0.0 111.299 -177.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.8 m -56.83 141.62 43.91 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.609 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 64' ' ' ASP . 57.7 tp -56.12 -41.87 75.97 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -176.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.561 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 43.4 t -58.34 -45.93 87.22 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.512 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 2.9 m-20 -66.49 -44.52 82.38 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.534 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -59.12 -46.35 88.57 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 124.302 1.041 . . . . 0.0 110.016 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.3 mtmt -64.18 -42.27 96.75 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.655 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.47 -38.63 87.94 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 12.6 mm100 -62.11 -47.97 82.26 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.317 0.579 . . . . 0.0 109.56 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.8 mt -68.72 -42.78 83.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.325 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.3 mtt -61.39 -40.82 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.22 0.208 . . . . 0.0 111.065 -178.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.25 -35.78 60.24 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.544 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.48 ' HD2' ' OH ' ' A' ' 11' ' ' TYR . 31.5 ttm180 -73.12 -44.55 60.07 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.833 0.349 . . . . 0.0 111.864 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.488 ' OE1' ' HD2' ' A' ' 16' ' ' LYS . 58.6 mm-40 -91.56 9.05 33.71 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.601 -176.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . 0.34 0.0 OUTLIER 45.55 66.52 0.9 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.004 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -93.81 145.27 24.72 Favored 'General case' 0 CA--C 1.491 -1.306 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.596 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 8.0 ptpp? -88.87 101.56 14.17 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.186 173.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.26 -13.79 59.87 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.019 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.21 8.56 23.45 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.62 0.724 . . . . 0.0 109.985 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.484 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 15.0 t70 -130.57 -45.19 1.08 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.563 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.564 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 13.3 p -132.72 167.86 19.37 Favored 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.236 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -123.01 170.99 9.59 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 13.9 tp -118.25 127.17 53.48 Favored 'General case' 0 C--N 1.265 -3.103 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.656 HE21 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -116.31 121.1 40.99 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.154 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.408 HD11 ' HG ' ' A' ' 51' ' ' LEU . 34.5 mm -106.73 135.57 44.7 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.7 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -173.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.8 m -122.72 148.02 45.8 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.4 t-20 -75.16 140.79 43.59 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.27 37.37 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.969 0.414 . . . . 0.0 111.278 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.628 HE21 ' HA ' ' A' ' 57' ' ' GLN . 0.0 OUTLIER -95.65 -47.3 6.27 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.855 -176.092 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -90.79 -21.45 21.51 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.164 0.507 . . . . 0.0 109.778 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.9 mmmt 66.74 26.7 9.46 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.475 1.11 . . . . 0.0 109.914 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -91.86 136.18 33.35 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -79.86 147.56 31.69 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.801 0.81 . . . . 0.0 111.382 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -103.9 95.88 6.31 Favored 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.6 p -80.44 -47.38 14.44 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 114.942 -1.026 . . . . 0.0 113.541 -172.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.431 ' O ' HD23 ' A' ' 31' ' ' LEU . 3.1 t70 -94.65 145.94 24.49 Favored 'General case' 0 CA--C 1.487 -1.455 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.397 -175.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.444 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 8.8 p-10 -69.72 -4.35 19.35 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -88.96 -7.11 56.64 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.971 175.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.49 150.41 48.9 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.78 138.13 52.89 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.598 -0.689 . . . . 0.0 111.609 -174.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -115.3 115.13 42.75 Favored Pre-proline 0 C--N 1.319 -0.732 0 C-N-CA 120.059 -0.657 . . . . 0.0 110.415 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 94.9 Cg_endo -80.48 153.89 20.93 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 C-N-CA 123.154 2.569 . . . . 0.0 113.19 176.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.572 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.4 pttt -59.24 -25.01 63.67 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.68 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -76.57 -5.56 48.21 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -116.13 133.88 55.54 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.408 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.8 m -91.48 137.0 32.71 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.4 m -128.0 154.14 38.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 CA-C-O 121.481 0.658 . . . . 0.0 111.87 -177.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.92 133.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.438 ' CG1' HD11 ' A' ' 51' ' ' LEU . 48.2 t -106.27 109.96 29.78 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-O 121.275 0.56 . . . . 0.0 110.326 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -108.57 132.95 53.35 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.564 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 34.7 ttp85 -95.68 129.77 42.78 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -126.75 156.43 73.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 CA--C 1.54 0.783 0 C-N-CA 122.158 1.905 . . . . 0.0 111.978 178.939 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.562 ' O ' ' HA ' ' A' ' 23' ' ' THR . 30.4 m . . . . . 0 N--CA 1.411 -2.403 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.4 p -139.73 135.6 33.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.517 -177.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 21' ' ' THR . 78.9 t -106.9 125.12 62.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -76.91 108.94 10.31 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 44.5 p90 -127.22 135.63 50.91 Favored 'General case' 0 C--N 1.28 -2.418 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -115.8 136.08 53.4 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.05 160.84 16.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.448 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 16.1 m -58.32 -30.32 66.6 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.53 0.681 . . . . 0.0 110.058 174.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.1 m -86.04 1.61 49.64 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.607 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 138.43 54.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.015 0.912 . . . . 0.0 111.878 177.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -85.96 -27.1 25.12 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -110.2 172.05 7.09 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.611 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -92.11 139.59 30.48 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.224 0.535 . . . . 0.0 112.038 -176.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.13 175.37 5.5 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 173.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.9 p -137.42 131.3 31.78 Favored 'General case' 0 CA--C 1.48 -1.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 7.9 p -109.63 125.32 66.79 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 7' ' ' SER . 4.2 p -90.95 140.99 29.31 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.691 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.504 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.3 p90 -150.57 174.14 13.31 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -107.02 140.81 39.23 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.54 -175.02 18.55 Favored Glycine 0 C--N 1.298 -1.565 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 tt -90.06 -40.68 12.14 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.548 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -133.45 155.26 49.86 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.969 -1.014 . . . . 0.0 112.15 -178.273 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.3 tt -121.62 126.6 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.522 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.431 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 13.2 m -60.31 146.88 42.43 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.505 177.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 62' ' ' TYR . 47.5 tp -58.91 -38.12 78.18 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 123.751 0.821 . . . . 0.0 111.399 -177.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.696 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.8 t -55.81 -46.9 77.94 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 175.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 22.2 m-20 -68.61 -41.91 78.87 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.352 -176.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.16 -46.67 70.12 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.035 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.6 mtmt -64.41 -42.86 95.82 Favored 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 121.307 -0.157 . . . . 0.0 111.365 -178.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.44 -36.82 81.45 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.418 0.449 . . . . 0.0 111.037 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 11.8 mm-40 -71.18 -44.37 65.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.334 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.5 mt -66.87 -40.42 85.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.508 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 59.9 mtt -60.36 -40.01 89.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.523 0.201 . . . . 0.0 110.511 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.8 -39.55 54.86 Favored Glycine 0 N--CA 1.438 -1.231 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.941 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -68.76 -49.55 57.78 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -82.37 -14.15 55.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.018 -173.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.7 mmtm 75.37 65.63 0.07 Allowed 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 125.85 1.66 . . . . 0.0 110.528 -178.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.75 152.64 19.46 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.696 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -104.82 102.13 11.7 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.907 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.37 -7.72 51.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.442 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -9.14 43.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.082 0.467 . . . . 0.0 110.545 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -112.1 -42.53 3.73 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.105 -178.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.8 m -129.86 171.67 12.48 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.03 -176.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -125.45 170.56 11.28 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.446 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.0 tp -120.9 115.78 23.89 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -173.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.514 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.6 tt0 -114.46 112.89 23.72 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.333 0.587 . . . . 0.0 110.277 -175.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.446 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.8 mp -99.01 135.27 34.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.793 -175.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -124.39 134.92 52.98 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 123.091 0.556 . . . . 0.0 109.513 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.516 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.2 t-20 -61.41 135.34 57.65 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.422 0.289 . . . . 0.0 110.277 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.41 -25.81 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.975 0.417 . . . . 0.0 111.442 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -93.34 -52.38 4.55 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.917 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.1 p -95.11 -15.84 23.07 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 62.47 26.61 15.84 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.799 0.809 . . . . 0.0 112.13 -174.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -73.17 116.66 13.96 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.29 126.65 34.97 Favored 'General case' 0 N--CA 1.42 -1.968 0 CA-C-O 121.397 0.618 . . . . 0.0 110.592 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.427 ' HB3' HD22 ' A' ' 31' ' ' LEU . 61.5 m-85 -99.3 104.18 16.06 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-N 114.698 -1.137 . . . . 0.0 108.252 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.2 p -113.52 -2.37 13.89 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.745 0.783 . . . . 0.0 110.34 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -106.08 131.93 52.77 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -65.58 -12.6 54.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-O 121.311 0.576 . . . . 0.0 111.404 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -91.6 2.13 56.67 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.789 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.61 147.79 47.23 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 173.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.548 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.99 138.48 52.79 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.265 0.484 . . . . 0.0 110.979 -176.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.17 113.89 35.24 Favored Pre-proline 0 C--N 1.314 -0.965 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.218 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.473 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 69.2 Cg_endo -76.89 152.74 32.46 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.086 2.524 . . . . 0.0 113.379 176.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.9 pttt -59.29 -23.74 62.68 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -78.76 -17.18 56.21 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.792 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.9 m -100.03 139.87 35.07 Favored 'General case' 0 C--N 1.308 -1.201 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.358 -175.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -99.38 136.58 39.11 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.2 m -130.99 155.84 42.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 120.952 0.406 . . . . 0.0 110.66 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.18 130.82 55.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 53' ' ' ILE . 27.0 t -105.78 113.23 42.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.318 -175.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 37.6 ttm180 -106.31 143.6 34.2 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.957 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -105.28 117.07 33.07 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.514 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -114.5 154.23 46.58 Favored Pre-proline 0 C--N 1.301 -1.535 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.406 -175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 C--N 1.325 -0.692 0 C-N-CA 122.621 2.214 . . . . 0.0 111.367 178.228 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 73.4 m . . . . . 0 N--CA 1.406 -2.637 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 34.4 m -133.1 134.86 44.83 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.069 -172.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.501 ' O ' ' HA ' ' A' ' 21' ' ' THR . 92.2 t -106.54 134.46 48.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.435 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 41.9 m-70 -84.22 123.06 29.71 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 123.775 0.672 . . . . 0.0 109.324 177.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.606 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 53.3 p90 -136.64 142.27 43.23 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.072 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.44 ' HE3' HD12 ' A' ' 76' ' ' ILE . 21.7 pttp -123.64 116.23 22.76 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 119.801 -0.759 . . . . 0.0 110.232 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.652 ' HA ' HG13 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -68.77 165.61 19.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.435 -1.257 . . . . 0.0 111.275 178.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.4 m -56.61 -37.1 70.2 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.967 176.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.3 t -106.84 19.78 19.98 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.056 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -99.64 138.4 36.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.69 -31.72 16.48 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.647 0.737 . . . . 0.0 109.708 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -129.94 177.14 7.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -83.34 146.83 28.28 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.062 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.4 t70 -115.2 178.66 4.21 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -136.57 121.74 19.11 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 118.734 0.697 . . . . 0.0 110.677 -172.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.1 p -95.87 134.68 32.51 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.408 HG22 ' SG ' ' A' ' 8' ' ' CYS . 5.3 p -102.66 126.51 49.78 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.146 0.498 . . . . 0.0 111.494 -175.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' A' ' 7' ' ' SER . 29.3 p90 -141.29 172.27 12.91 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -106.83 137.5 44.75 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.0 -167.05 12.36 Favored Glycine 0 N--CA 1.429 -1.82 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.401 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.2 tm? -98.03 -31.63 12.05 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.631 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.16 147.67 33.99 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -112.16 123.95 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.297 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.9 m -63.97 143.32 57.95 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.953 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 46.8 tp -54.84 -41.05 70.27 Favored 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 124.684 1.194 . . . . 0.0 112.533 -175.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.639 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 32.2 t -53.18 -45.9 68.74 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 123.219 0.325 . . . . 0.0 110.339 176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.7 -39.8 61.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.523 0.678 . . . . 0.0 110.02 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 3.0 tm? -58.77 -47.21 85.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.287 -177.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.3 mtmt -70.68 -44.76 66.36 Favored 'General case' 0 C--O 1.203 -1.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.218 -178.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.0 mptp? -61.29 -37.71 84.16 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -175.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -64.64 -45.19 87.84 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.459 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.5 mt -73.95 -41.48 53.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.029 -176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 88.8 mtp -62.25 -37.64 86.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.708 0.289 . . . . 0.0 110.576 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.46 -42.4 41.31 Favored Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.781 176.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -64.73 -47.65 77.48 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -89.09 11.16 19.24 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.488 -175.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? 55.06 62.09 2.66 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 123.94 0.896 . . . . 0.0 111.169 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -91.61 145.88 24.24 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.567 177.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.621 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -95.13 101.77 13.54 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.58 -8.55 55.78 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.964 -175.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -90.18 -1.73 57.97 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.932 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.619 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 16.6 t70 -129.08 -37.12 1.71 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.453 0.644 . . . . 0.0 110.474 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -128.78 166.12 19.62 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-O 121.814 0.816 . . . . 0.0 112.424 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.47 169.32 12.52 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 126.02 1.728 . . . . 0.0 106.687 176.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.5 tp -117.42 111.25 19.06 Favored 'General case' 0 N--CA 1.404 -2.749 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.573 HE21 HG21 ' A' ' 80' ' ' ILE . 9.4 tt0 -109.34 111.23 22.67 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.593 0.711 . . . . 0.0 109.853 -178.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' HG23 ' A' ' 77' ' ' VAL . 18.7 mm -92.95 136.18 25.68 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -123.37 143.19 50.27 Favored 'General case' 0 C--N 1.275 -2.654 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.433 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.0 t-20 -68.58 136.22 52.72 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 122.039 -0.413 . . . . 0.0 110.559 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -28.18 64.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -91.21 -58.18 2.54 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 121.186 0.517 . . . . 0.0 111.192 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 p -91.68 -17.44 25.47 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.195 -169.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.94 23.41 12.59 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.621 0.724 . . . . 0.0 112.549 -173.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.03 115.95 7.31 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -87.4 128.15 35.21 Favored 'General case' 0 N--CA 1.413 -2.293 0 CA-C-O 121.874 0.845 . . . . 0.0 110.174 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.2 93.53 8.73 Favored 'General case' 0 C--N 1.267 -2.995 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.062 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.8 p -98.36 -26.83 14.35 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.521 -1.218 . . . . 0.0 111.032 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -90.11 135.17 33.82 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 5.3 m-20 -68.81 -13.15 62.22 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.895 0.379 . . . . 0.0 111.801 -176.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -83.59 -9.19 59.08 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.155 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.12 136.25 57.67 Favored 'General case' 0 C--O 1.2 -1.513 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.631 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -117.82 137.65 52.61 Favored 'General case' 0 C--N 1.281 -2.391 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.221 -176.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -117.04 118.79 35.74 Favored Pre-proline 0 C--N 1.297 -1.693 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.729 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.3 Cg_endo -78.68 157.94 28.23 Favored 'Trans proline' 0 C--N 1.324 -0.718 0 C-N-CA 123.218 2.612 . . . . 0.0 113.404 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 49.6 pttt -70.19 -5.48 27.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.9 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -87.83 -4.27 58.88 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.759 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -122.43 157.94 30.82 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-O 120.973 0.416 . . . . 0.0 111.247 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m -118.86 137.76 53.21 Favored 'General case' 0 N--CA 1.422 -1.837 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 12.5 m -130.48 163.85 35.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.48 0.657 . . . . 0.0 111.697 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 ' HE3' ' A' ' 12' ' ' LYS . 13.9 mm -109.47 132.28 58.05 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.652 HG13 ' HA ' ' A' ' 13' ' ' PHE . 1.7 p -112.78 106.55 20.99 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 122.173 0.987 . . . . 0.0 111.207 -177.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -103.26 131.79 50.03 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.843 -174.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -90.51 117.57 29.3 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.573 HG21 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -116.6 151.56 47.26 Favored Pre-proline 0 C--N 1.308 -1.219 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -177.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo . . . . . 0 CA--C 1.549 1.248 0 C-N-CA 122.399 2.066 . . . . 0.0 112.362 178.995 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 71' ' ' LYS . 67.4 m . . . . . 0 N--CA 1.406 -2.657 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.1 p -144.73 135.14 24.37 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.084 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 71' ' ' LYS . 69.0 t -106.19 125.63 61.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -81.05 117.31 21.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 124.185 0.928 . . . . 0.0 108.874 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.621 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -133.26 140.55 47.55 Favored 'General case' 0 C--N 1.29 -1.995 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -124.26 140.92 52.5 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.62 165.68 18.8 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 m -56.55 -37.36 70.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.812 0.815 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.92 -3.87 55.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.573 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -110.52 143.34 41.01 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.9 tp -94.99 -37.73 11.0 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.573 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -99.97 158.02 16.12 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.391 -0.523 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.65 137.14 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 116.07 -0.514 . . . . 0.0 112.039 -176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -95.31 174.7 6.91 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 171.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -138.34 133.91 33.58 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -175.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.626 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.3 m -94.9 114.92 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 171.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -90.21 114.41 26.39 Favored 'General case' 0 N--CA 1.41 -2.46 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.152 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.434 ' CE1' HG23 ' A' ' 9' ' ' VAL . 5.5 p90 -135.83 165.39 25.73 Favored 'General case' 0 C--N 1.282 -2.327 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -177.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 6.01 32.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -174.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.48 -178.52 45.37 Favored Glycine 0 C--N 1.285 -2.25 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.577 177.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -89.78 -39.84 12.86 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.81 153.27 44.4 Favored 'General case' 0 CA--C 1.488 -1.437 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.045 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.0 tt -123.47 129.41 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.242 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.711 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -63.11 145.0 56.41 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.234 178.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.1 tp -54.99 -44.43 74.48 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.502 1.121 . . . . 0.0 112.981 -176.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.547 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.8 t -57.0 -45.58 82.9 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.148 0.499 . . . . 0.0 109.755 178.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 9.4 m-20 -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.146 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.77 95.96 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.04 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' HD23 ' A' ' 51' ' ' LEU . 54.7 mtmt -63.11 -41.55 99.38 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.252 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.61 -37.46 84.0 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.593 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.531 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -66.03 -50.23 64.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.083 0.468 . . . . 0.0 109.796 178.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.32 -43.36 91.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.632 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' HD22 ' A' ' 44' ' ' LEU . 71.7 mtm -66.02 -34.99 79.35 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.222 -0.191 . . . . 0.0 111.264 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.2 -39.98 51.12 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.496 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.416 HH22 ' HA ' ' A' ' 22' ' ' VAL . 23.7 ttm180 -67.47 -48.03 68.36 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 123.375 0.67 . . . . 0.0 112.151 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -91.49 2.11 56.66 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.316 -174.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.39 65.45 1.17 Allowed 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 124.444 1.098 . . . . 0.0 111.28 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 ' HG2' ' A' ' 39' ' ' MET . 10.8 mp -95.09 173.55 7.52 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.21 177.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HG3' ' SG ' ' A' ' 49' ' ' CYS . 16.8 ptpt -105.95 101.33 10.83 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.334 178.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.92 -13.29 59.89 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.384 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.58 4.68 45.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.997 0.427 . . . . 0.0 111.211 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -124.72 -40.53 2.19 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.391 0.615 . . . . 0.0 109.464 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.462 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 24.4 p -134.03 164.35 27.52 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.963 -178.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -116.12 170.36 8.56 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.508 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.8 tp -115.43 123.71 49.3 Favored 'General case' 0 C--N 1.267 -3.019 0 CA-C-O 121.456 0.646 . . . . 0.0 109.283 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.552 ' HB2' HG12 ' A' ' 80' ' ' ILE . 5.1 tp-100 -103.4 123.94 47.78 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -177.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.412 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.1 mp -116.79 127.83 74.32 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.3 m -115.73 146.89 41.5 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.616 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -77.0 138.14 39.42 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.16 -21.42 46.48 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.683 0.754 . . . . 0.0 110.987 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -98.53 -56.23 2.52 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.927 -175.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.9 p -85.93 -19.65 30.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.553 0.692 . . . . 0.0 109.672 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.1 mmtp 63.45 21.07 12.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.914 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -77.89 129.51 35.46 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -93.62 127.82 39.49 Favored 'General case' 0 N--CA 1.416 -2.13 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -94.65 96.0 9.13 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -92.54 -21.14 20.28 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.025 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.622 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 12.8 m-20 -97.92 133.35 42.52 Favored 'General case' 0 CA--C 1.492 -1.275 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.475 ' HA ' HD23 ' A' ' 31' ' ' LEU . 3.1 p30 -73.39 -4.07 31.22 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -175.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.622 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 6.9 p30 -85.35 -10.05 56.83 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.043 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.0 146.11 48.28 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.494 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.45 137.42 52.52 Favored 'General case' 0 C--N 1.289 -2.041 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.328 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.65 114.44 39.92 Favored Pre-proline 0 N--CA 1.435 -1.193 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.065 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.0 Cg_endo -78.89 156.67 27.16 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.166 2.577 . . . . 0.0 112.389 176.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.484 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.62 -7.48 33.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.925 0.869 . . . . 0.0 111.811 178.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -83.43 -11.88 57.04 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.39 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.9 m -112.58 152.25 29.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 120.888 0.375 . . . . 0.0 111.366 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.9 m -109.9 132.42 54.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 173.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.621 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.8 m -127.39 160.52 36.37 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -175.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.1 mm -112.29 132.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 HG13 ' A' ' 53' ' ' ILE . 25.0 t -109.24 129.71 63.51 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 CA-C-O 121.086 0.47 . . . . 0.0 110.789 -175.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 52' ' ' GLN . 29.4 ttm180 -126.61 152.26 46.88 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 125.225 1.41 . . . . 0.0 107.744 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.406 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 18.3 ttp180 -110.24 127.74 55.14 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.552 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.9 pp -132.59 161.58 62.43 Favored Pre-proline 0 C--O 1.21 -0.995 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.693 -175.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 33.2 Cg_endo . . . . . 0 N--CA 1.48 0.728 0 C-N-CA 122.362 2.041 . . . . 0.0 112.12 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 46.0 m . . . . . 0 N--CA 1.424 -1.739 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.642 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.6 p -147.78 142.41 26.6 Favored 'General case' 0 N--CA 1.422 -1.826 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.608 -175.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.8 t -107.18 136.55 41.87 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 178.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -83.32 109.54 17.36 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HG13 ' A' ' 22' ' ' VAL . 30.9 p90 -124.81 140.2 53.14 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 19' ' ' TYR . 63.8 pttt -125.68 123.2 38.38 Favored 'General case' 0 C--N 1.293 -1.872 0 C-N-CA 118.443 -1.303 . . . . 0.0 110.956 174.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 1.4 t80 -84.34 172.44 11.79 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.276 -176.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -64.13 -27.0 68.78 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.563 0.697 . . . . 0.0 109.232 170.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.7 m -82.57 -20.32 36.77 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.338 178.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.56 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 0.9 OUTLIER -111.65 101.46 9.85 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.76 -33.27 75.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.592 0.71 . . . . 0.0 110.646 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -114.36 169.19 9.22 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.633 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.445 ' HA ' ' HB3' ' A' ' 12' ' ' LYS . 98.5 m-85 -70.5 147.64 49.15 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -121.88 177.35 5.33 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 104.615 -2.365 . . . . 0.0 104.615 176.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.8 p -135.64 127.19 28.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -95.97 114.95 33.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.574 171.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 7' ' ' SER . 2.2 p -85.47 124.86 32.54 Favored 'General case' 0 N--CA 1.418 -2.045 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 7' ' ' SER . 38.5 p90 -142.28 176.68 8.8 Favored 'General case' 0 N--CA 1.434 -1.266 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -105.35 136.66 44.48 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.687 0.279 . . . . 0.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.95 -147.74 18.5 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.533 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.33 -39.8 4.32 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.75 157.86 45.3 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.432 -179.069 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -128.35 129.43 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.092 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.336 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.8 m -61.66 148.08 43.76 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.054 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.45 HD23 ' O ' ' A' ' 64' ' ' ASP . 51.7 tp -57.48 -41.53 80.87 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 124.186 0.994 . . . . 0.0 112.547 -176.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.678 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 48.0 t -55.61 -46.47 77.33 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 4.5 m-20 -69.88 -42.57 73.27 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.28 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.416 ' HG ' HD13 ' A' ' 69' ' ' ILE . 2.5 tm? -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 124.03 0.932 . . . . 0.0 110.361 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.9 mtmt -67.19 -38.3 85.15 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.566 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.678 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 1.6 mptm? -61.39 -36.57 80.64 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -64.4 -50.09 69.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 109.491 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.2 mt -73.01 -41.4 59.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.471 -174.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.4 mtt -59.94 -44.43 94.37 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 110.455 -0.202 . . . . 0.0 110.455 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.78 -33.7 71.29 Favored Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.727 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -71.92 -46.44 57.61 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -91.5 -1.5 57.51 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 120.858 0.361 . . . . 0.0 111.943 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm 66.93 66.96 0.42 Allowed 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 125.08 1.352 . . . . 0.0 110.363 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.81 170.01 9.61 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 17.9 ptpt -112.46 101.72 9.87 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.099 175.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.15 -6.6 59.54 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.364 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.94 -3.97 53.56 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.389 0.614 . . . . 0.0 110.171 177.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.417 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 31.8 t70 -128.68 -30.3 2.31 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.58 0.705 . . . . 0.0 111.486 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.6 m -132.06 157.24 44.67 Favored 'General case' 0 N--CA 1.414 -2.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.38 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.481 ' HB3' HD11 ' A' ' 80' ' ' ILE . 37.5 t0 -120.01 162.19 19.66 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 53' ' ' ILE . 21.3 tp -108.92 108.13 18.77 Favored 'General case' 0 C--N 1.257 -3.429 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 -177.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.464 HE21 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -97.53 116.66 30.17 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-O 121.693 0.759 . . . . 0.0 109.249 -174.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.579 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.2 mm -105.26 130.52 56.36 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.757 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 m -125.02 141.59 52.03 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.59 128.9 38.51 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 122.594 0.357 . . . . 0.0 110.955 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.87 -29.51 65.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.24 0.543 . . . . 0.0 110.341 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -87.78 -58.11 2.69 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.862 -177.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.4 p -90.64 -14.28 32.66 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -171.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.17 21.69 12.98 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 123.344 0.658 . . . . 0.0 112.769 -172.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -74.74 121.87 22.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -92.31 119.54 31.99 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.571 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 87.7 m-85 -55.72 -65.29 0.62 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 123.645 0.778 . . . . 0.0 112.416 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.8 p 74.41 -36.8 0.34 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 127.802 2.441 . . . . 0.0 114.631 171.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' HD23 ' A' ' 31' ' ' LEU . 4.6 t70 -95.49 132.88 40.12 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -174.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 9.5 m-20 -65.27 -14.18 60.14 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.24 0.543 . . . . 0.0 111.703 -175.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -91.97 -1.97 56.99 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.48 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -72.49 145.1 47.76 Favored 'General case' 0 C--O 1.194 -1.836 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.53 138.32 51.98 Favored 'General case' 0 C--N 1.288 -2.104 0 CA-C-N 118.825 0.739 . . . . 0.0 111.399 -173.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.494 HG13 ' CZ ' ' A' ' 62' ' ' TYR . 3.2 mp -114.06 115.51 45.5 Favored Pre-proline 0 C--N 1.312 -1.042 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.506 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 92.3 Cg_endo -81.11 159.62 20.57 Favored 'Trans proline' 0 C--N 1.324 -0.761 0 C-N-CA 123.116 2.544 . . . . 0.0 113.479 175.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -73.35 4.83 4.18 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.966 176.049 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -87.54 -19.07 28.39 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.0 m -109.63 162.31 14.55 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.625 0.726 . . . . 0.0 112.765 -173.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.4 m -121.51 130.56 53.62 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.6 m -129.01 158.79 41.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.4 mm -99.69 129.17 50.68 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.562 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 59.9 t -109.74 111.48 36.33 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 CA-C-O 121.556 0.693 . . . . 0.0 109.46 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.0 ttp-105 -121.23 136.34 54.99 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.824 -174.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -93.08 128.35 38.95 Favored 'General case' 0 C--N 1.292 -1.899 0 O-C-N 121.954 -0.466 . . . . 0.0 110.216 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.481 HD11 ' HB3' ' A' ' 50' ' ' ASP . 2.5 pp -125.72 152.37 72.16 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 C--N 1.326 -0.649 0 C-N-CA 122.153 1.902 . . . . 0.0 111.117 177.003 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.522 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 49.5 m . . . . . 0 N--CA 1.408 -2.545 0 CA-C-O 120.671 0.272 . . . . 0.0 110.411 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.3 p -145.01 141.77 29.21 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.007 -178.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.515 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.2 t -107.02 129.9 59.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -80.61 110.85 16.49 Favored 'General case' 0 CA--C 1.491 -1.293 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 174.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.607 ' OH ' ' HG2' ' A' ' 41' ' ' ARG . 37.6 p90 -131.9 146.37 52.07 Favored 'General case' 0 C--N 1.28 -2.449 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -130.55 141.98 50.47 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.501 ' HZ ' HD21 ' A' ' 44' ' ' LEU . 1.1 t80 -89.81 169.35 11.34 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -177.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.2 m -56.93 -37.01 70.89 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.999 0.428 . . . . 0.0 111.297 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.7 m -90.99 4.02 53.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 25.9 mtpp -117.62 125.93 51.62 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.0 tt -83.26 -42.0 17.7 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.2 157.81 20.53 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -88.44 146.78 25.03 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 120.964 0.411 . . . . 0.0 110.698 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -112.06 174.76 5.73 Favored 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 p -139.37 115.71 10.5 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.144 0.497 . . . . 0.0 111.238 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.8 p -95.86 120.85 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.082 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 177.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.0 p -87.95 140.24 29.7 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.515 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.8 p90 -151.94 170.89 18.75 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -178.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -102.45 138.29 39.57 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.09 -173.91 17.06 Favored Glycine 0 N--CA 1.433 -1.509 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -88.66 -31.32 18.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.563 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -147.69 157.5 43.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -175.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 tt -121.73 128.5 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.247 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 16.3 m -63.79 147.09 52.65 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.223 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 64' ' ' ASP . 48.2 tp -57.81 -42.77 84.97 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 124.019 0.927 . . . . 0.0 112.419 -176.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -54.25 -45.17 72.33 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 19.2 m-20 -68.23 -49.69 59.01 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.463 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.2 -45.47 91.0 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.822 -1.081 . . . . 0.0 112.746 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' HD23 ' A' ' 51' ' ' LEU . 51.9 mtmt -63.05 -41.49 99.49 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.785 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.613 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.3 mptp? -61.58 -38.48 87.68 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 120.664 0.268 . . . . 0.0 110.373 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 15.4 mm100 -68.15 -50.15 56.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.69 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.8 mt -70.47 -39.07 75.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.7 mtm -64.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.967 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.36 -35.53 56.29 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.449 175.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 25.3 tpt180 -61.06 -51.17 70.31 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.197 0.999 . . . . 0.0 111.9 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.38 -1.12 54.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.86 0.362 . . . . 0.0 111.856 -176.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm 66.22 68.5 0.44 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 125.092 1.357 . . . . 0.0 110.48 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 ' HZ ' ' A' ' 13' ' ' PHE . 9.3 mp -95.52 158.22 15.55 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.793 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' HD3' ' HB2' ' A' ' 48' ' ' ASP . 8.1 ptpp? -85.1 101.04 12.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 170.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.72 -7.49 59.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -169.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.22 -12.85 17.7 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.705 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.473 ' HB2' ' HD3' ' A' ' 45' ' ' LYS . 4.0 m-20 -105.93 -16.5 14.62 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -175.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -148.03 170.29 18.07 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -120.94 164.9 16.0 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.475 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.5 tp -116.27 113.62 23.24 Favored 'General case' 0 N--CA 1.405 -2.724 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.539 ' HB2' HG12 ' A' ' 80' ' ' ILE . 33.8 tt0 -111.13 112.0 23.49 Favored 'General case' 0 C--N 1.281 -2.402 0 CA-C-O 121.781 0.801 . . . . 0.0 109.23 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.434 ' CD1' HG13 ' A' ' 77' ' ' VAL . 29.0 mm -90.53 135.77 25.68 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.48 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.663 -172.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 14.9 m -117.88 145.33 44.7 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.4 t-20 -74.73 141.98 44.42 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -84.97 -27.52 26.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.715 0.769 . . . . 0.0 110.62 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -85.03 -48.68 8.99 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.559 -175.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -98.1 -20.27 17.45 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.252 0.548 . . . . 0.0 110.076 -176.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 60.79 36.96 19.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.675 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -101.27 132.57 46.72 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 1.1 mp0 -81.69 148.11 29.16 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-O 121.878 0.847 . . . . 0.0 112.36 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -108.14 101.11 10.37 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 173.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.8 p -97.97 -27.26 14.33 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.286 0.565 . . . . 0.0 112.013 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' HD23 ' A' ' 31' ' ' LEU . 29.8 m-20 -91.01 128.46 36.84 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -177.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -66.96 -6.26 16.05 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -95.32 1.77 54.52 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.749 178.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.53 152.72 43.67 Favored 'General case' 0 C--O 1.207 -1.182 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 173.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.563 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.83 138.29 52.82 Favored 'General case' 0 C--N 1.289 -2.031 0 O-C-N 121.77 -0.581 . . . . 0.0 111.473 -178.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.49 117.16 38.55 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.223 175.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.476 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 74.0 Cg_endo -80.21 161.17 23.21 Favored 'Trans proline' 0 C--N 1.328 -0.523 0 C-N-CA 123.522 2.815 . . . . 0.0 114.064 177.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.522 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 47.4 pttt -67.62 -16.37 64.13 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.222 176.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -70.87 -25.64 62.89 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.796 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.8 m -98.32 159.68 14.79 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-O 121.639 0.733 . . . . 0.0 112.17 -173.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.9 m -124.01 127.87 48.54 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 173.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 55' ' ' ASN . 21.9 m -125.38 155.0 34.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 CA-C-O 121.593 0.711 . . . . 0.0 112.8 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.4 mm -104.16 127.84 58.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.475 ' CG1' HD11 ' A' ' 51' ' ' LEU . 60.0 t -99.46 111.58 29.46 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.519 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.359 -175.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -110.55 130.93 55.45 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.889 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -89.75 127.55 35.97 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.539 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.85 150.11 55.04 Favored Pre-proline 0 C--N 1.305 -1.364 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.085 -178.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo . . . . . 0 N--CA 1.448 -1.165 0 C-N-CA 122.063 1.842 . . . . 0.0 112.196 178.838 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.1 m . . . . . 0 N--CA 1.414 -2.264 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.5 p -127.29 128.61 46.25 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.075 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 71' ' ' LYS . 41.2 t -106.93 131.05 57.88 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -86.64 112.7 21.86 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.1 p90 -126.2 133.23 51.59 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.867 -177.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -118.35 135.74 54.14 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.134 -1.026 . . . . 0.0 108.962 175.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.533 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 1.2 t80 -92.52 165.34 13.07 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -176.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -56.86 -31.95 65.32 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.45 0.643 . . . . 0.0 109.799 175.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.5 m -82.68 -8.73 59.58 Favored 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.959 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD2' ' H ' ' A' ' 13' ' ' PHE . 65.5 mttm -108.66 146.33 33.6 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 121.928 -0.483 . . . . 0.0 110.72 -177.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.4 tp -92.65 -46.19 7.71 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 171.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -97.24 155.87 16.67 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.778 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -75.8 135.96 40.25 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 121.305 0.574 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -94.74 177.85 5.78 Favored 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -137.48 128.11 26.85 Favored 'General case' 0 C--N 1.28 -2.44 0 CA-C-N 118.432 0.56 . . . . 0.0 111.462 -174.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.528 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -113.22 136.28 50.07 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.0 p -112.28 138.76 48.52 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 120.849 0.357 . . . . 0.0 111.517 -178.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.567 ' HE1' HG23 ' A' ' 9' ' ' VAL . 35.1 p90 -151.57 176.3 11.48 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.69 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -103.82 150.11 24.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 175.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.07 161.52 34.19 Favored Glycine 0 C--N 1.303 -1.296 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 tt -71.88 -32.79 67.79 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 118.074 0.937 . . . . 0.0 108.841 -177.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.518 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -138.5 159.8 41.16 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.369 -176.142 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.8 tt -128.66 128.15 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.593 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -56.83 142.27 41.53 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.893 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.2 tp -58.23 -34.77 70.8 Favored 'General case' 0 N--CA 1.419 -1.994 0 C-N-CA 124.738 1.215 . . . . 0.0 110.727 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.698 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 11.7 t -58.36 -46.49 86.2 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -74.42 -41.46 60.84 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.613 -176.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.5 tm? -59.0 -47.34 85.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.001 1.32 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.5 mtmt -67.05 -43.29 83.08 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 120.535 0.207 . . . . 0.0 111.021 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.698 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.92 -35.19 77.67 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.83 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.03 -49.95 72.62 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 120.881 0.372 . . . . 0.0 110.152 175.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.8 mt -69.17 -44.85 80.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.739 -175.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 73.8 mtm -66.05 -39.89 90.49 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.238 -178.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.24 -37.11 86.22 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.038 -1.077 . . . . 0.0 111.221 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -65.43 -49.03 70.69 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 123.065 0.546 . . . . 0.0 111.836 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 46.5 mt-10 -103.34 19.6 19.36 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.8 mmtt 62.16 34.11 16.44 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.676 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.8 mp -71.96 132.77 44.77 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.068 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 16.4 ptpt -71.86 101.4 2.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 122.144 0.973 . . . . 0.0 111.293 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.71 -7.91 57.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.896 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.83 -0.4 45.23 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.574 0.702 . . . . 0.0 110.349 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.465 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 9.3 t70 -113.05 -41.18 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.032 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -133.34 166.7 21.89 Favored 'General case' 0 N--CA 1.415 -2.225 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.459 -174.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -116.86 166.66 11.9 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.546 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 14.2 tp -112.79 125.45 54.36 Favored 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -111.52 109.04 18.77 Favored 'General case' 0 C--N 1.284 -2.277 0 O-C-N 121.777 -0.577 . . . . 0.0 109.709 -177.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.467 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.9 mp -99.69 125.65 53.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 CA-C-O 121.388 0.613 . . . . 0.0 110.084 -176.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.9 m -115.22 137.1 52.39 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.7 t-20 -67.15 138.24 56.89 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.76 -20.82 41.83 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.499 0.666 . . . . 0.0 111.263 -177.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -98.83 -47.33 5.33 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.384 -174.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 42.8 p -95.15 -22.59 17.76 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.4 0.619 . . . . 0.0 109.938 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 69.68 21.58 6.51 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 125.394 1.478 . . . . 0.0 111.538 -175.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.52 119.53 12.47 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.669 -1.151 . . . . 0.0 108.419 176.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -90.16 121.02 31.82 Favored 'General case' 0 N--CA 1.411 -2.386 0 CA-C-O 121.522 0.677 . . . . 0.0 110.889 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -93.21 100.77 13.08 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -100.64 -22.34 14.96 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.768 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' O ' HD23 ' A' ' 31' ' ' LEU . 7.2 t70 -99.94 137.87 37.79 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.625 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -60.03 -19.55 53.26 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -78.4 -8.73 58.8 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.9 152.16 45.1 Favored 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.518 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.4 138.6 52.98 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 118.604 0.638 . . . . 0.0 112.516 -176.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.21 115.23 38.28 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.57 173.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 47.3 Cg_endo -77.76 151.39 28.15 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.991 2.46 . . . . 0.0 113.016 174.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.588 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -67.18 -10.87 54.79 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.973 0.892 . . . . 0.0 113.294 -177.714 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -87.18 -4.77 59.13 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.875 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.6 m -109.73 143.15 39.92 Favored 'General case' 0 N--CA 1.426 -1.648 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.1 m -103.58 129.08 50.75 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.5 m -124.45 159.59 30.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -174.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -101.39 134.49 41.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.1 t -114.58 114.44 46.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 CA-C-O 121.053 0.454 . . . . 0.0 109.784 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -113.62 132.29 55.81 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.613 -177.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -85.96 121.88 29.22 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.587 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -123.25 147.99 53.67 Favored Pre-proline 0 C--O 1.206 -1.221 0 C-N-CA 120.551 -0.46 . . . . 0.0 109.916 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--N 1.31 -1.45 0 C-N-CA 121.989 1.793 . . . . 0.0 111.255 179.573 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.492 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 18.0 m . . . . . 0 N--CA 1.402 -2.851 0 CA-C-O 121.653 0.74 . . . . 0.0 111.113 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -138.69 129.04 25.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.091 -177.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 21' ' ' THR . 51.3 t -107.23 132.12 55.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.502 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 49.4 m-70 -80.8 108.83 14.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.58 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 32.8 p90 -124.37 137.48 54.46 Favored 'General case' 0 C--N 1.281 -2.373 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -120.32 133.29 55.48 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 174.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -88.88 153.71 20.83 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 -177.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.2 p -68.45 -12.45 61.21 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.383 0.611 . . . . 0.0 111.484 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.9 p -87.78 -9.72 53.11 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.307 0.575 . . . . 0.0 109.884 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -113.66 -176.96 3.02 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.3 tp -134.23 -20.69 1.88 Allowed 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.346 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -104.77 157.37 17.24 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.23 147.68 27.86 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.455 175.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 6.9 t70 -123.43 178.69 5.04 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 5.6 p -130.05 115.41 17.06 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 118.551 0.614 . . . . 0.0 110.916 -173.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -95.54 135.62 29.08 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.018 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 7' ' ' SER . 10.0 p -105.46 146.04 30.04 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -174.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.5 p90 -156.51 176.44 12.7 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -113.06 135.0 54.27 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 173.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.53 177.43 16.32 Favored Glycine 0 N--CA 1.425 -2.04 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -81.47 -32.41 32.54 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.64 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -148.99 160.08 43.64 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.973 -175.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.4 tt -126.24 128.01 71.22 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.008 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.8 m -61.94 147.93 45.28 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.35 0.66 . . . . 0.0 111.093 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 43.5 tp -54.67 -46.34 74.01 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.485 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -56.05 -45.31 79.26 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 120.969 0.414 . . . . 0.0 109.959 179.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.04 -41.23 82.39 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.611 0.719 . . . . 0.0 111.073 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.8 -46.8 87.95 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.555 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HA ' HD23 ' A' ' 51' ' ' LEU . 57.9 mtmt -66.11 -39.39 89.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.828 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.7 mptp? -61.63 -39.38 91.1 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.227 0.329 . . . . 0.0 111.488 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -66.62 -47.69 71.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.273 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.11 -47.39 78.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.4 mtm -64.72 -38.26 90.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.908 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.55 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.925 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -71.92 -50.14 31.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.079 0.466 . . . . 0.0 111.327 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.32 -9.75 58.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.486 -173.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm 71.71 62.29 0.15 Allowed 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 125.316 1.446 . . . . 0.0 110.564 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.03 158.36 15.59 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.044 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -106.83 104.41 14.09 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 122.171 0.986 . . . . 0.0 109.706 176.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.65 61.8 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.158 -176.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.49 58.09 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.188 0.518 . . . . 0.0 110.782 178.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.596 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 19.2 t70 -117.04 -39.61 3.21 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.727 0.775 . . . . 0.0 110.102 178.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.5 p -138.8 160.81 38.78 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.833 -174.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -115.31 167.39 10.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.0 tp -114.57 109.82 18.85 Favored 'General case' 0 N--CA 1.404 -2.747 0 CA-C-O 121.502 0.668 . . . . 0.0 109.62 -174.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.0 tt0 -94.15 120.78 34.88 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -176.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.468 HD11 ' HG ' ' A' ' 51' ' ' LEU . 25.8 mm -109.02 130.87 61.21 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.472 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -176.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.8 m -120.38 147.54 44.92 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.487 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.6 t-20 -78.33 138.67 38.68 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.07 37.77 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.444 0.64 . . . . 0.0 110.933 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -95.79 -51.89 4.31 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.594 -173.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -89.73 -18.27 26.68 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.524 0.678 . . . . 0.0 109.789 -176.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.6 mmmt 65.4 24.13 12.01 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.078 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -84.75 129.45 34.82 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -85.87 127.42 34.58 Favored 'General case' 0 N--CA 1.417 -2.086 0 CA-C-O 121.626 0.727 . . . . 0.0 109.716 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.14 93.91 8.25 Favored 'General case' 0 C--N 1.272 -2.765 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.074 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -88.36 -28.35 21.03 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.342 -1.299 . . . . 0.0 113.446 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -99.9 146.08 27.07 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.6 m-20 -73.34 -5.95 42.98 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.5 -11.76 53.42 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.888 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 31' ' ' LEU . . . -60.71 114.08 2.82 Favored 'General case' 0 C--O 1.203 -1.345 0 O-C-N 124.074 0.859 . . . . 0.0 111.298 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.64 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -91.6 138.65 31.4 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.443 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.73 115.6 43.78 Favored Pre-proline 0 C--N 1.301 -1.5 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.669 173.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.6 Cg_endo -79.57 158.5 25.31 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.449 2.766 . . . . 0.0 113.232 176.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 52.5 pttt -68.48 -4.33 14.6 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.617 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -86.74 -11.09 52.12 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.209 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.6 m -118.71 154.33 32.93 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 m -109.37 131.76 54.77 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.47 HG12 ' HA ' ' A' ' 55' ' ' ASN . 19.0 m -126.11 157.44 36.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-O 121.854 0.835 . . . . 0.0 112.882 -175.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mm -99.23 127.25 52.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.435 ' CG1' HD11 ' A' ' 51' ' ' LEU . 58.3 t -108.45 114.31 46.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.382 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -118.4 138.64 52.31 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.566 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -93.33 122.92 36.24 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.568 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -124.08 153.8 68.05 Favored Pre-proline 0 C--N 1.31 -1.149 0 O-C-N 122.195 -0.315 . . . . 0.0 110.596 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo . . . . . 0 C--N 1.323 -0.776 0 C-N-CA 121.828 1.685 . . . . 0.0 111.199 178.956 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.401 -2.901 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.606 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.1 p -133.39 134.6 43.9 Favored 'General case' 0 C--N 1.294 -1.829 0 C-N-CA 120.22 -0.592 . . . . 0.0 111.41 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.5 HG23 ' CE1' ' A' ' 24' ' ' PHE . 52.0 t -107.32 123.42 62.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.861 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -78.3 114.36 17.12 Favored 'General case' 0 N--CA 1.419 -2.001 0 O-C-N 124.152 0.907 . . . . 0.0 108.907 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.524 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 50.0 p90 -125.05 131.94 53.28 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -117.37 131.22 56.82 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 118.404 -1.318 . . . . 0.0 109.304 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.453 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -86.17 156.68 20.23 Favored 'General case' 0 C--N 1.273 -2.748 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -177.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.3 p -60.26 -27.79 67.53 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.243 0.544 . . . . 0.0 110.527 175.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.6 m -96.78 8.43 44.33 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.703 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HD3' ' CB ' ' A' ' 13' ' ' PHE . 5.9 mptp? -108.69 157.16 18.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.11 -34.24 13.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.197 0.522 . . . . 0.0 110.52 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -133.37 175.98 8.93 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -77.11 141.82 40.03 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.336 0.589 . . . . 0.0 111.38 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -108.33 177.31 4.83 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 p -136.79 136.47 38.88 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -175.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -98.72 122.27 50.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 167.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.0 p -93.86 123.54 37.28 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.5 ' CE1' HG23 ' A' ' 9' ' ' VAL . 47.0 p90 -140.94 177.36 8.1 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -178.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -120.27 118.59 30.84 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.461 0.573 . . . . 0.0 112.355 -175.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 134.69 -113.89 1.2 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.86 174.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -131.48 -45.23 0.99 Allowed 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.613 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -141.18 161.66 37.35 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -125.16 127.75 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.133 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.8 m -58.83 137.92 57.51 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.525 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.441 HD11 ' CG1' ' A' ' 53' ' ' ILE . 53.2 tp -54.79 -41.7 70.88 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 124.432 1.093 . . . . 0.0 112.672 -175.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 8.1 t -57.42 -45.42 84.64 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.2 t70 -66.41 -42.36 87.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -64.94 -46.87 79.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.883 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.564 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 41.3 mtmt -69.04 -37.89 78.84 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.813 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.7 mptt -61.84 -39.49 92.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.003 177.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 74.7 mt-30 -64.02 -50.88 66.71 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.018 177.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.79 -46.59 96.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.854 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG2' HD22 ' A' ' 44' ' ' LEU . 67.3 mtm -64.92 -38.34 90.63 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.879 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.86 -33.31 57.84 Favored Glycine 0 C--N 1.315 -0.636 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.156 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -72.96 -48.49 36.26 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 123.463 0.705 . . . . 0.0 112.013 -177.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -95.47 -0.45 52.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.166 0.508 . . . . 0.0 112.125 -173.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.419 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 44.5 mmtt 67.35 68.23 0.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.904 177.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD22 ' HG2' ' A' ' 39' ' ' MET . 11.1 mp -98.1 170.74 8.7 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.075 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -109.88 101.7 10.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.501 0.667 . . . . 0.0 110.106 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.15 -9.04 59.87 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 123.683 0.793 . . . . 0.0 111.271 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.3 -5.63 54.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -131.54 -29.82 1.72 Allowed 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.06 0.933 . . . . 0.0 110.814 -176.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.5 m -130.01 159.35 36.96 Favored 'General case' 0 N--CA 1.399 -3.004 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -176.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -118.36 169.56 9.64 Favored 'General case' 0 C--N 1.287 -2.119 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.564 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 24.0 tp -114.15 119.02 35.68 Favored 'General case' 0 C--N 1.248 -3.812 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.502 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.5 tt0 -113.22 117.2 31.21 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 -175.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.441 ' CG1' HD11 ' A' ' 31' ' ' LEU . 39.2 mm -99.91 135.55 35.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.695 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -176.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 m -123.65 145.36 49.01 Favored 'General case' 0 C--N 1.287 -2.145 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -71.17 139.29 50.14 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.766 -0.584 . . . . 0.0 109.915 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.22 56.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.921 0.391 . . . . 0.0 111.336 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -94.69 -48.29 6.13 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.69 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.2 p -95.31 -19.24 20.14 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.769 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 59.58 41.62 18.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -94.94 126.63 40.4 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -80.87 135.42 35.92 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-O 120.848 0.356 . . . . 0.0 110.238 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -94.0 100.45 12.58 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -83.2 -47.32 11.69 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.682 -1.145 . . . . 0.0 114.06 -170.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -90.97 147.48 23.07 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -78.11 -1.43 32.45 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.298 0.57 . . . . 0.0 112.306 -176.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -92.79 -2.43 55.96 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.943 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.55 148.64 51.39 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 174.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.613 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -118.91 138.76 52.54 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 118.237 0.471 . . . . 0.0 111.634 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.26 117.25 36.81 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.239 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.4 Cg_endo -78.34 154.43 28.2 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 123.779 2.986 . . . . 0.0 114.514 177.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -65.05 -10.52 30.69 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.397 1.079 . . . . 0.0 111.776 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.57 -10.46 51.5 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.049 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.9 m -107.57 155.37 20.19 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.291 0.567 . . . . 0.0 111.435 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -118.85 132.91 56.13 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 173.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 55' ' ' ASN . 18.8 m -128.64 162.38 35.64 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -104.45 132.84 50.12 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.484 ' CG1' HD11 ' A' ' 51' ' ' LEU . 42.8 t -106.46 113.96 44.43 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.178 0 CA-C-O 121.206 0.526 . . . . 0.0 110.015 -178.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 24.8 tpp180 -110.38 125.11 52.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.102 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -90.28 120.21 31.23 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 174.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.502 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.03 152.25 50.08 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.683 -176.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo . . . . . 0 C--O 1.245 0.856 0 C-N-CA 122.212 1.941 . . . . 0.0 111.053 176.244 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.422 -1.872 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.6 p -137.36 138.9 40.4 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.528 -179.297 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.554 HG23 ' HE1' ' A' ' 24' ' ' PHE . 41.5 t -107.38 134.98 47.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.467 -179.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -82.95 109.68 17.27 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 174.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.6 p90 -122.5 134.4 54.57 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -115.74 132.11 56.73 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 117.744 -1.583 . . . . 0.0 109.174 175.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.31 155.65 17.4 Favored 'General case' 0 C--N 1.275 -2.645 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -62.62 -25.8 68.29 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.578 0.704 . . . . 0.0 110.655 175.601 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.1 -3.09 50.83 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.984 178.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -106.31 172.39 6.84 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.8 tp -102.1 -45.8 5.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 176.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -122.69 -171.01 2.19 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.167 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.9 148.1 34.73 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.496 0.665 . . . . 0.0 111.623 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -114.45 178.51 4.26 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 176.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 3.1 p -132.17 131.97 42.75 Favored 'General case' 0 N--CA 1.414 -2.242 0 CA-C-N 118.908 0.776 . . . . 0.0 110.64 -175.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.6 p -110.2 130.77 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.191 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 176.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -102.03 141.94 34.1 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -174.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.9 p90 -155.76 177.38 11.46 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -116.86 155.49 28.93 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.13 -135.64 12.96 Favored Glycine 0 C--N 1.31 -0.912 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 -178.715 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.451 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 2.8 tm? -122.9 -42.84 2.27 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.489 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -136.29 159.01 43.05 Favored 'General case' 0 CA--C 1.478 -1.804 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.662 -177.274 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -121.21 126.71 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.638 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.5 m -57.64 140.53 50.91 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.178 176.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 62' ' ' TYR . 50.1 tp -57.87 -40.26 79.78 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 123.17 0.588 . . . . 0.0 112.491 -176.319 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 19.7 t -55.18 -46.92 75.84 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.622 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -66.03 -47.7 73.56 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.74 179.611 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.91 -46.61 89.97 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 123.561 0.538 . . . . 0.0 112.14 -177.066 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' HD23 ' A' ' 51' ' ' LEU . 50.1 mtmt -66.08 -45.13 82.34 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.302 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -62.0 -35.56 78.89 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.271 0.357 . . . . 0.0 111.1 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 29.3 mm-40 -63.7 -50.6 68.55 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.425 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.6 mt -66.25 -45.57 89.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.566 -176.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 67.8 mtm -64.66 -40.5 95.54 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.278 -177.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.04 -41.59 47.43 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.235 179.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.63 -47.37 63.65 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 17.6 mm-40 -89.55 -2.74 58.43 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt 71.21 65.92 0.16 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 125.153 1.381 . . . . 0.0 111.288 178.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.436 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.9 mp -103.38 156.99 17.34 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.124 -0.944 . . . . 0.0 108.582 175.516 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -94.31 100.62 12.63 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 122.005 0.907 . . . . 0.0 109.782 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.08 -17.04 61.0 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.108 -174.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -98.2 1.73 47.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 179.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -124.3 -28.17 3.7 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.232 -0.987 . . . . 0.0 111.581 -177.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.4 p -135.68 159.65 40.98 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.716 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -108.47 157.34 18.53 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -179.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.455 HD11 ' CG1' ' A' ' 77' ' ' VAL . 23.6 tp -113.1 116.62 30.16 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.067 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.497 ' HB2' HG12 ' A' ' 80' ' ' ILE . 25.1 tt0 -116.21 115.08 25.35 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 121.806 0.812 . . . . 0.0 109.645 -176.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.425 HD12 HG22 ' A' ' 77' ' ' VAL . 27.4 mm -97.25 135.55 31.11 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 -174.293 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 m -121.19 141.36 50.93 Favored 'General case' 0 C--N 1.283 -2.294 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.467 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 12.4 t-20 -75.1 139.75 42.98 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.677 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.0 -28.54 39.42 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.336 0.589 . . . . 0.0 111.173 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -92.09 -49.18 6.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.425 -174.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.1 p -93.64 -19.79 20.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.982 0.42 . . . . 0.0 110.129 -174.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.2 mmmt 65.75 24.01 11.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.559 1.144 . . . . 0.0 111.139 -178.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -82.29 131.3 35.23 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -90.36 135.27 33.79 Favored 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 177.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 63.2 m-85 -101.25 97.12 7.67 Favored 'General case' 0 C--N 1.263 -3.19 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.223 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -100.15 -25.39 14.3 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.985 -177.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -94.07 128.99 40.77 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -176.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -61.6 -10.74 8.9 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -91.68 -2.08 57.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.637 -178.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.29 151.14 47.35 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.16 138.94 52.59 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 118.385 0.539 . . . . 0.0 111.007 -177.642 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.48 113.98 36.45 Favored Pre-proline 0 C--N 1.315 -0.93 0 C-N-CA 119.689 -0.805 . . . . 0.0 110.445 173.027 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.564 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.7 Cg_endo -79.43 158.68 25.79 Favored 'Trans proline' 0 CA--C 1.519 -0.256 0 C-N-CA 123.128 2.552 . . . . 0.0 113.245 177.032 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.486 ' HD3' HD22 ' A' ' 72' ' ' ASN . 0.0 OUTLIER -70.48 5.15 1.92 Allowed 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 121.57 0.7 . . . . 0.0 111.9 176.339 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.486 HD22 ' HD3' ' A' ' 71' ' ' LYS . 1.0 OUTLIER -87.95 -20.52 25.78 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.023 172.891 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -103.42 141.7 35.52 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -174.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -104.0 128.43 51.56 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 169.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 ' HA ' ' A' ' 55' ' ' ASN . 14.6 m -123.17 157.28 28.87 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.7 mm -103.71 125.96 58.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.455 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.4 t -100.78 114.27 39.26 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-O 121.397 0.617 . . . . 0.0 110.429 -177.515 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -113.11 138.85 49.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.887 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -100.41 128.52 46.45 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.497 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -127.85 153.61 78.09 Favored Pre-proline 0 C--N 1.312 -1.036 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 CA--C 1.537 0.668 0 C-N-CA 121.977 1.784 . . . . 0.0 111.993 179.012 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 71' ' ' LYS . 36.1 m . . . . . 0 N--CA 1.409 -2.495 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.7 p -139.59 134.84 32.68 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.629 -179.034 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' CE1' ' A' ' 24' ' ' PHE . 59.6 t -107.35 135.67 45.12 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.458 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -83.92 113.32 20.89 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.195 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 29.5 p90 -129.51 136.56 50.0 Favored 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.218 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -121.79 141.01 51.64 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 173.273 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.559 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -91.66 175.87 6.74 Favored 'General case' 0 C--N 1.277 -2.566 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 177.059 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -63.43 -30.65 71.74 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 171.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.4 m -79.53 -7.04 58.2 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.682 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.559 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 3.8 mptp? -105.06 134.25 48.48 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.302 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.27 -19.47 22.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.629 0.728 . . . . 0.0 109.226 178.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.449 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 8.2 p30 -129.96 173.92 10.25 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.553 179.012 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.89 129.05 36.96 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.268 0.556 . . . . 0.0 112.179 -177.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -89.58 177.59 6.51 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.55 -1.205 . . . . 0.0 108.47 175.092 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -135.76 131.49 35.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.169 0.509 . . . . 0.0 110.87 -177.238 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.5 p -113.75 127.54 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.086 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 7' ' ' SER . 8.5 p -99.83 143.69 29.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.374 0.606 . . . . 0.0 112.142 -176.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.532 ' CE1' HG23 ' A' ' 9' ' ' VAL . 17.2 p90 -153.23 171.03 19.14 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.157 178.014 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.14 135.33 51.82 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.12 -115.02 2.08 Favored Glycine 0 C--N 1.302 -1.341 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tt -149.14 -41.11 0.15 Allowed 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 1.1 p-80 -134.81 157.25 47.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 179.521 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 tt -122.78 125.67 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.993 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.553 -179.014 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.1 m -58.23 141.25 51.29 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.908 173.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.449 HD11 HD13 ' A' ' 53' ' ' ILE . 57.9 tp -54.63 -41.23 69.78 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.918 1.287 . . . . 0.0 111.409 -177.435 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.654 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 53.7 t -54.33 -45.24 72.63 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.452 178.198 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -72.63 -43.07 63.72 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 -176.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.499 ' CD2' HD13 ' A' ' 69' ' ' ILE . 0.6 OUTLIER -67.02 -40.85 87.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.24 -174.477 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.456 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 53.1 mtmt -62.36 -38.82 91.0 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.782 -179.431 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.654 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 3.9 mptp? -61.75 -40.42 95.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.638 177.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -63.18 -51.1 67.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.783 179.435 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.6 mt -68.81 -42.83 82.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.418 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.428 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.2 mtm -64.0 -35.25 80.07 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.384 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.5 -39.16 50.87 Favored Glycine 0 C--N 1.309 -0.924 0 C-N-CA 120.308 -0.948 . . . . 0.0 111.541 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -66.77 -43.41 84.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.893 0.877 . . . . 0.0 112.549 -177.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 76.5 mm-40 -99.95 3.61 44.46 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.882 0.373 . . . . 0.0 110.993 -178.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.4 mptt 57.86 66.51 1.11 Allowed 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.387 178.11 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -98.85 154.23 18.18 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.179 177.564 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 47' ' ' ALA . 23.7 ttmm -97.69 111.62 23.83 Favored 'General case' 0 N--CA 1.401 -2.893 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.98 -1.69 26.89 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.794 -178.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.33 -12.06 18.94 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.377 -177.038 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.89 -37.06 6.8 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.392 0.615 . . . . 0.0 110.323 -177.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.7 m -141.43 174.36 10.62 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.441 -178.442 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -119.44 169.87 9.65 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.9 tp -114.52 122.26 46.02 Favored 'General case' 0 C--N 1.273 -2.76 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -113.55 123.34 49.76 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -177.113 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.498 HG12 HD11 ' A' ' 34' ' ' LEU . 2.1 mp -102.94 132.11 49.8 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.84 0 C-N-CA 119.867 -0.733 . . . . 0.0 109.115 179.204 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.4 m -117.27 146.92 42.99 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 179.376 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.542 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.7 t-20 -74.59 138.6 43.11 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' HG13 ' A' ' 76' ' ' ILE . . . -76.88 -25.77 53.43 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-O 121.211 0.529 . . . . 0.0 110.379 -178.419 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -92.78 -56.52 2.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.553 -176.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.5 p -90.83 -16.27 28.57 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.248 -171.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 64.03 18.44 11.22 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -174.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.18 125.89 28.08 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 175.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -89.51 125.67 35.28 Favored 'General case' 0 C--N 1.288 -2.094 0 CA-C-O 121.298 0.57 . . . . 0.0 110.676 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -92.61 100.15 12.73 Favored 'General case' 0 C--N 1.278 -2.507 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.4 p -98.2 -26.09 14.67 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.743 -175.577 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -95.35 135.54 36.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.2 m-20 -64.19 -17.85 63.93 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.493 0.717 . . . . 0.0 110.784 -178.073 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -81.64 -8.75 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.727 -178.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.83 144.36 56.66 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.624 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.73 137.68 52.53 Favored 'General case' 0 C--N 1.294 -1.835 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -176.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.499 HD13 ' CD2' ' A' ' 34' ' ' LEU . 3.8 mp -119.69 116.48 33.16 Favored Pre-proline 0 C--N 1.302 -1.477 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.236 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.525 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 75.8 Cg_endo -80.75 160.8 21.64 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.373 2.716 . . . . 0.0 113.879 177.735 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 7' ' ' SER . 53.4 pttt -63.79 -8.74 11.58 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.93 175.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -81.48 -17.38 48.88 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.646 178.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 37.8 m -105.81 152.74 22.85 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.784 0.802 . . . . 0.0 111.856 -175.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 m -114.45 129.75 56.68 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 170.184 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.652 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.6 m -128.57 164.28 30.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 120.909 0.385 . . . . 0.0 110.917 -176.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 56' ' ' ALA . 51.0 mt -122.8 129.04 75.43 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 53' ' ' ILE . 20.3 t -100.39 132.62 45.67 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.468 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.089 -173.091 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -130.26 143.16 50.61 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 -176.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -97.36 134.07 41.12 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 pp -124.77 148.9 60.88 Favored Pre-proline 0 C--N 1.303 -1.429 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.934 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 N--CA 1.447 -1.254 0 C-N-CA 122.188 1.925 . . . . 0.0 111.713 178.761 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.4 m . . . . . 0 N--CA 1.405 -2.684 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.543 ' SG ' HG22 ' A' ' 23' ' ' THR . 83.8 m -138.38 133.51 33.0 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.917 -174.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.55 HG23 ' CE1' ' A' ' 24' ' ' PHE . 79.1 t -106.14 130.52 57.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 42.7 m-70 -88.63 120.17 29.78 Favored 'General case' 0 CA--C 1.482 -1.652 0 O-C-N 124.227 0.954 . . . . 0.0 109.106 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.632 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.1 p90 -132.95 139.93 47.56 Favored 'General case' 0 C--N 1.278 -2.515 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.22 148.49 43.62 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.536 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -85.97 165.45 16.72 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.957 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -66.08 -30.9 71.5 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.2 t -74.34 -57.11 4.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.87 176.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 13' ' ' PHE . 54.5 mtmt -67.4 143.22 56.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.094 0.557 . . . . 0.0 111.7 -178.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.15 -37.65 14.05 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.162 -175.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -100.76 163.23 12.42 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.528 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -87.94 152.17 22.26 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.374 0.607 . . . . 0.0 111.553 -177.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.47 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.8 t70 -121.71 176.69 5.59 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 176.449 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 4.6 p -133.33 131.17 39.81 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -95.5 117.33 39.26 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.165 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 170.157 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.543 HG22 ' SG ' ' A' ' 8' ' ' CYS . 39.9 p -86.01 121.41 28.59 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.406 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.566 ' O ' ' HB2' ' A' ' 7' ' ' SER . 16.0 p90 -143.24 161.6 37.85 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -178.106 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -101.13 132.51 46.57 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.0 -163.39 23.49 Favored Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -177.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 58.0 tp -106.97 -35.52 6.88 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 176.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.532 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -144.3 156.94 44.48 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.261 -179.242 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -126.14 131.15 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.91 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.432 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.8 m -64.98 145.54 56.2 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.131 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 47.6 tp -54.87 -46.27 74.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -172.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.491 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 12.7 t -58.57 -42.73 88.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 118.994 0.815 . . . . 0.0 109.87 179.412 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 6.1 m-20 -65.06 -43.51 92.0 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.132 179.193 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.29 -46.34 90.17 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.893 -179.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 52.4 mtmt -66.78 -40.57 88.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 -179.92 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.2 mptt -61.87 -34.41 75.96 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.668 178.116 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 13.3 mm100 -65.4 -50.1 66.75 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 110.102 176.115 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.3 mt -68.61 -47.13 78.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.604 -176.689 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.0 mtm -63.09 -44.3 96.11 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.17 -178.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -39.03 91.56 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.834 179.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.03 -51.51 63.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.085 0.469 . . . . 0.0 110.745 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -97.43 11.26 37.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -171.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt 67.67 38.89 2.88 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.426 1.09 . . . . 0.0 112.036 171.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.07 167.34 22.05 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.388 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -105.47 102.43 11.9 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.681 178.762 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.62 -13.7 60.04 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.52 -176.792 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.58 -6.85 59.12 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.871 -179.1 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -126.62 -33.08 2.57 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.511 0.672 . . . . 0.0 111.107 178.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.3 m -129.27 161.71 29.58 Favored 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.337 -175.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -118.81 171.26 8.34 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 178.171 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.464 HD11 ' CG1' ' A' ' 77' ' ' VAL . 18.2 tp -118.48 117.69 29.71 Favored 'General case' 0 N--CA 1.395 -3.193 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -174.067 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.562 HE21 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -101.4 123.53 45.62 Favored 'General case' 0 C--N 1.284 -2.249 0 O-C-N 120.932 -1.105 . . . . 0.0 108.408 -177.714 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 51' ' ' LEU . 32.8 mm -110.23 130.67 63.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -173.222 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.7 m -117.13 139.48 50.68 Favored 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.371 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.8 t-20 -65.79 136.5 56.28 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 176.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.33 -26.18 55.51 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.254 0.549 . . . . 0.0 111.427 -177.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -95.69 -52.2 4.2 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.28 -176.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -90.16 -18.61 25.47 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.25 0.548 . . . . 0.0 110.223 -174.112 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 66.05 21.83 11.21 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.731 1.212 . . . . 0.0 112.153 -177.239 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -70.72 121.63 18.32 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.597 174.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -90.18 117.98 29.35 Favored 'General case' 0 N--CA 1.405 -2.723 0 CA-C-O 122.0 0.905 . . . . 0.0 110.838 -178.06 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -87.63 92.84 9.25 Favored 'General case' 0 C--N 1.272 -2.767 0 CA-C-N 114.101 -1.408 . . . . 0.0 107.75 -179.583 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.8 p -93.23 -17.77 23.28 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.375 -176.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -101.55 128.82 47.63 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.388 -178.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 7.8 p-10 -67.72 -7.08 24.23 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -90.79 -2.87 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.447 176.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.2 150.56 47.34 Favored 'General case' 0 C--O 1.206 -1.205 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.203 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.532 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.04 138.33 52.29 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 118.085 0.402 . . . . 0.0 110.84 -177.071 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.28 116.04 37.63 Favored Pre-proline 0 C--N 1.314 -0.956 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.563 176.11 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.0 Cg_endo -79.39 158.77 25.96 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 123.162 2.574 . . . . 0.0 113.418 176.036 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -66.67 -10.26 44.49 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.659 178.194 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -87.77 -3.88 58.92 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.386 178.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -112.59 150.88 30.76 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 121.261 0.553 . . . . 0.0 111.476 -178.091 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -109.73 126.7 54.0 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 13.9 m -124.57 164.77 22.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.424 0.63 . . . . 0.0 112.553 -176.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -124.3 136.07 61.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 C-N-CA 124.295 1.038 . . . . 0.0 108.728 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.464 ' CG1' HD11 ' A' ' 51' ' ' LEU . 41.2 t -104.17 129.28 56.69 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.612 -172.323 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -129.01 140.65 51.55 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -98.64 131.94 44.43 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.607 178.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -128.93 152.84 79.82 Favored Pre-proline 0 C--O 1.206 -1.199 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.029 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 C--N 1.318 -1.069 0 C-N-CA 122.308 2.006 . . . . 0.0 111.579 177.985 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.474 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 64.1 m . . . . . 0 N--CA 1.412 -2.357 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 27.3 p -144.25 144.48 31.53 Favored 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.531 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.2 t -105.57 132.43 52.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.331 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -82.84 104.7 13.26 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CD2' HG21 ' A' ' 77' ' ' VAL . 38.2 p90 -120.71 141.23 50.62 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 -177.426 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -124.51 126.09 45.29 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 118.102 -1.439 . . . . 0.0 110.164 175.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.26 157.2 19.99 Favored 'General case' 0 C--N 1.286 -2.166 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 178.176 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.7 m -60.0 -25.06 64.97 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 120.809 0.338 . . . . 0.0 111.53 177.479 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 t -95.1 -4.75 45.69 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 121.549 0.69 . . . . 0.0 110.615 178.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.24 -43.3 11.08 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 121.712 -0.618 . . . . 0.0 110.642 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 71.89 -47.31 0.66 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.478 1.511 . . . . 0.0 111.722 -176.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -100.92 169.44 8.97 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 175.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -83.36 144.96 29.31 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.536 0.684 . . . . 0.0 112.059 -176.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -113.91 177.97 4.45 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 176.012 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.68 123.0 17.05 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.519 0.599 . . . . 0.0 110.875 -174.005 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -102.36 119.68 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 176.696 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 p -87.58 134.52 33.61 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.138 -178.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.531 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.7 p90 -144.79 176.0 9.77 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.715 -177.287 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -103.9 131.19 51.37 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.73 179.83 20.88 Favored Glycine 0 C--O 1.209 -1.407 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.338 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -83.49 -31.62 26.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.54 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -136.93 157.35 46.95 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.58 -177.862 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.06 132.48 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.783 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.573 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.461 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 6.3 m -60.83 145.49 49.72 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.408 0.683 . . . . 0.0 109.976 177.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.9 tp -57.7 -43.1 84.94 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 124.134 0.974 . . . . 0.0 112.729 -176.306 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.5 t -59.13 -45.6 90.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.636 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 14.1 m-20 -62.71 -48.77 77.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.824 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.13 -46.54 89.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.405 -176.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 39' ' ' MET . 45.6 mtmt -65.46 -44.41 87.29 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.602 -179.151 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.3 mptt -61.92 -33.45 74.28 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 116.72 -0.218 . . . . 0.0 111.263 178.251 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 24.5 mm-40 -63.76 -49.83 71.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.9 mt -67.4 -49.43 71.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.439 -177.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 93.6 mtp -61.68 -44.91 96.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.497 -175.282 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.72 61.54 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.305 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -72.74 -51.03 20.87 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.32 0.581 . . . . 0.0 111.628 -177.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -87.04 -9.47 55.41 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -170.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt 76.66 67.06 0.05 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 124.683 1.193 . . . . 0.0 111.654 -179.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -104.12 129.48 51.83 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 173.684 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.57 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 23.9 ttmm -77.67 112.7 14.76 Favored 'General case' 0 N--CA 1.408 -2.573 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.256 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -0.9 30.27 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.079 -178.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.452 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -103.03 3.24 35.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.487 0.66 . . . . 0.0 109.297 178.849 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.57 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 23.0 t70 -118.59 -51.13 2.4 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.407 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.3 m -134.05 168.04 19.54 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.064 179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -113.6 169.47 8.95 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 -179.773 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.563 HD11 ' CG1' ' A' ' 77' ' ' VAL . 26.2 tp -116.78 125.32 51.44 Favored 'General case' 0 C--N 1.271 -2.832 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.567 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -115.99 136.5 52.98 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -179.576 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.468 HD12 HG22 ' A' ' 77' ' ' VAL . 39.0 mm -121.87 135.59 61.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -176.428 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.2 m -128.77 144.51 51.19 Favored 'General case' 0 C--O 1.196 -1.741 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 176.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.539 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.6 t-20 -72.95 138.43 46.11 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.737 -0.602 . . . . 0.0 109.869 179.679 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.86 -26.19 49.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.237 0.541 . . . . 0.0 111.015 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -94.69 -52.41 4.3 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.475 -176.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 p -90.88 -16.27 28.47 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.202 0.525 . . . . 0.0 110.47 -172.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 66.01 21.79 11.26 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.962 -179.522 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -83.61 130.92 34.99 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.417 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.25 143.94 33.29 Favored 'General case' 0 N--CA 1.416 -2.14 0 CA-C-O 121.024 0.44 . . . . 0.0 110.151 174.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 91.7 m-85 -103.92 99.06 8.82 Favored 'General case' 0 C--N 1.273 -2.74 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.04 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.2 p -91.32 -27.24 18.52 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.804 -173.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -101.34 143.58 31.21 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.5 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.3 p-10 -74.35 -11.07 60.15 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.733 0.301 . . . . 0.0 111.785 -177.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -3.46 58.83 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.703 178.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.86 58.66 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 174.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.54 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.52 137.74 52.36 Favored 'General case' 0 C--N 1.289 -2.051 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.338 -174.685 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.27 117.37 34.91 Favored Pre-proline 0 C--N 1.306 -1.303 0 C-N-CA 119.616 -0.833 . . . . 0.0 110.551 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 55.7 Cg_endo -76.86 152.76 32.62 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.374 2.716 . . . . 0.0 113.244 175.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.474 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 42.4 pttt -57.69 -22.2 44.84 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -86.95 -1.75 58.08 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 120.961 0.41 . . . . 0.0 111.756 -177.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -106.9 147.23 30.05 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 -178.424 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.4 p -109.13 124.39 50.73 Favored 'General case' 0 N--CA 1.424 -1.727 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 55' ' ' ASN . 15.9 m -123.39 149.98 27.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.569 0.7 . . . . 0.0 112.65 -177.44 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.6 mm -94.18 126.07 46.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 178.876 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.563 ' CG1' HD11 ' A' ' 51' ' ' LEU . 59.7 t -106.51 122.03 59.88 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -177.152 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -126.04 134.41 51.44 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.24 -173.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -90.27 116.78 28.5 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.419 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.77 150.52 48.54 Favored Pre-proline 0 C--N 1.308 -1.226 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.276 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--N 1.325 -0.668 0 C-N-CA 122.182 1.922 . . . . 0.0 111.876 -179.086 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 m . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.9 p -149.6 145.29 26.7 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 119.681 -0.808 . . . . 0.0 110.896 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.0 t -107.02 128.74 61.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.341 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.444 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 21.6 m-70 -77.68 105.54 8.91 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 173.89 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.559 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 33.7 p90 -123.41 140.82 52.62 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -178.305 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -117.02 137.77 52.02 Favored 'General case' 0 C--N 1.286 -2.182 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 172.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.459 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 2.2 t80 -89.9 166.69 13.35 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -178.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.4 t -58.94 -31.5 68.74 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.627 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 m -84.6 -7.07 59.38 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.31 -179.982 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.459 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 95.6 mttt -116.87 124.38 49.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.422 0.629 . . . . 0.0 110.67 -177.12 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -81.93 -20.57 38.4 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.651 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -114.01 164.69 13.47 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.372 -0.831 . . . . 0.0 108.8 179.852 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -83.94 148.22 27.04 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 121.87 0.843 . . . . 0.0 111.601 -179.586 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.8 t0 -120.0 178.04 4.76 Favored 'General case' 0 C--N 1.279 -2.463 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -134.85 128.52 32.85 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 118.209 0.459 . . . . 0.0 110.07 -175.536 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.552 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.3 p -106.9 122.26 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.144 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.2 p -89.41 135.31 33.66 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -177.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.478 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.1 p90 -146.73 165.61 29.12 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -176.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -95.55 111.05 23.04 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 123.953 0.783 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.74 -174.17 20.26 Favored Glycine 0 C--N 1.298 -1.539 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 tt -95.27 -26.87 15.77 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 177.434 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.3 OUTLIER -143.31 151.76 40.88 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.465 178.699 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.5 tt -125.91 135.06 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.925 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.622 -177.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -62.17 141.75 58.01 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.383 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.557 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 52.1 tp -57.1 -43.22 82.03 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 123.502 0.721 . . . . 0.0 112.404 -175.616 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.532 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.4 t -56.45 -45.32 80.87 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.061 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -65.32 -42.06 93.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.376 179.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.61 -46.53 87.85 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 -179.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 44.7 mtmt -66.02 -40.43 91.07 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.248 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.89 -39.47 92.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.303 176.439 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -65.34 -50.72 64.54 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.629 177.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 75.7 mt -62.76 -48.29 88.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 123.562 0.539 . . . . 0.0 111.986 -177.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.6 mtm -64.72 -37.3 87.12 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.635 -178.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.91 64.14 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.188 -1.006 . . . . 0.0 111.36 177.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -63.51 -45.1 92.2 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.173 0.989 . . . . 0.0 111.658 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 31.7 mt-10 -103.39 3.33 35.01 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.907 -176.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.27 66.13 0.91 Allowed 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 124.614 1.166 . . . . 0.0 111.664 178.052 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.5 mp -98.69 135.09 40.69 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.597 177.553 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 39.4 ttmt -77.79 108.33 10.94 Favored 'General case' 0 N--CA 1.414 -2.247 0 CA-C-O 121.45 0.643 . . . . 0.0 109.951 179.143 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.55 1.67 25.02 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.16 179.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.429 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.17 -0.88 35.23 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.65 0.738 . . . . 0.0 109.852 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.5 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 12.2 t70 -115.68 -36.33 4.25 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.001 -1.0 . . . . 0.0 108.412 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 17.1 p -143.32 168.68 19.23 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.962 -174.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -116.12 169.38 9.31 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 177.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.531 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.4 tp -120.32 123.01 42.08 Favored 'General case' 0 C--N 1.259 -3.342 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 -178.401 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.576 ' HB2' HG12 ' A' ' 80' ' ' ILE . 41.9 tt0 -115.54 119.21 35.4 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -175.326 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.435 HG13 HG22 ' A' ' 77' ' ' VAL . 1.7 mp -105.87 132.56 52.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 CA-C-O 121.407 0.622 . . . . 0.0 111.032 -176.138 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.4 m -113.94 148.63 36.5 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.344 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.534 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -75.35 141.81 43.27 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 175.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.34 -28.33 42.04 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 0.0 110.989 -178.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -93.89 -53.33 4.04 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.384 -175.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -84.95 -22.47 29.19 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -174.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 65.57 23.07 11.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.408 -175.833 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.47 132.18 36.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.226 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -91.15 117.11 29.35 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-O 121.505 0.669 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -86.77 93.72 9.34 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.405 HG22 HE21 ' A' ' 52' ' ' GLN . 19.3 p -92.42 -10.01 39.56 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.492 -177.413 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.784 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 10.5 m-20 -101.73 132.09 47.64 Favored 'General case' 0 CA--C 1.479 -1.769 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.837 176.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.46 0.22 30.39 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.269 0.557 . . . . 0.0 111.666 -178.786 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.784 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 9.7 p30 -90.66 1.8 56.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.797 178.337 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.31 154.47 40.94 Favored 'General case' 0 C--O 1.208 -1.091 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.45 137.39 53.2 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.42 116.68 33.44 Favored Pre-proline 0 C--N 1.302 -1.46 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.396 177.009 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -80.15 155.94 22.75 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.294 2.662 . . . . 0.0 113.75 176.559 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 13.6 ptmt -58.3 -21.43 49.01 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.825 178.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -87.11 -1.25 57.75 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 120.818 0.342 . . . . 0.0 111.6 -177.617 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.6 m -112.81 149.03 33.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.424 -178.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.4 p -109.39 132.49 54.08 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.9 m -132.03 160.76 42.24 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 121.405 0.621 . . . . 0.0 112.556 -177.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -108.53 125.57 65.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 179.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 51' ' ' LEU . 43.3 t -104.86 109.72 28.51 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-O 121.517 0.675 . . . . 0.0 109.759 -177.244 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -113.58 129.16 56.61 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.255 -175.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.579 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 56.5 ttp180 -91.6 129.87 37.5 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -179.213 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.576 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -130.38 153.3 81.28 Favored Pre-proline 0 C--N 1.309 -1.189 0 C-N-CA 121.116 -0.234 . . . . 0.0 110.413 -175.653 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 CA--C 1.539 0.734 0 C-N-CA 121.931 1.754 . . . . 0.0 111.122 178.103 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.783 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -63.71 114.72 2.69 Favored 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.218 1.945 . . . . 0.0 110.954 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp -71.38 123.29 21.99 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.8 -116.07 0.75 Allowed Glycine 0 N--CA 1.425 -2.089 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 m -93.02 2.0 57.01 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 121.461 0.648 . . . . 0.0 111.297 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.439 ' CE ' ' HA ' ' A' ' 6' ' ' MET . 2.0 mmt -92.73 150.72 20.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.265 0.555 . . . . 0.0 110.179 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 55.3 m -136.59 120.2 17.17 Favored 'General case' 0 N--CA 1.413 -2.32 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.551 ' SG ' HG22 ' A' ' 23' ' ' THR . 58.0 m -125.86 128.93 48.38 Favored 'General case' 0 C--N 1.291 -1.945 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.195 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' CE1' ' A' ' 24' ' ' PHE . 25.3 t -108.11 124.66 64.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.853 175.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -81.29 105.98 12.91 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.03 -0.987 . . . . 0.0 108.377 173.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.583 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.0 p90 -118.6 126.01 51.03 Favored 'General case' 0 C--N 1.278 -2.535 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.14 133.07 50.53 Favored 'General case' 0 C--N 1.278 -2.515 0 C-N-CA 118.536 -1.265 . . . . 0.0 107.688 176.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.402 ' HA ' ' HB ' ' A' ' 77' ' ' VAL . 1.0 OUTLIER -82.93 150.52 26.39 Favored 'General case' 0 C--N 1.282 -2.333 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 178.044 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 p -64.43 -24.79 67.75 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.43 0.633 . . . . 0.0 110.648 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 m -80.47 -15.59 56.39 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.861 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.443 ' HB3' ' OD1' ' A' ' 18' ' ' ASN . 82.3 mttt -104.44 157.78 16.93 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.82 0.819 . . . . 0.0 112.492 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -96.74 1.24 50.68 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.054 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.443 ' OD1' ' HB3' ' A' ' 16' ' ' LYS . 30.3 p-10 -145.6 164.91 30.25 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.787 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -91.82 139.4 30.71 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.04 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.17 177.62 4.75 Favored 'General case' 0 C--N 1.279 -2.46 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -144.26 120.83 11.08 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -172.198 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.431 HG13 ' CE1' ' A' ' 11' ' ' TYR . 1.9 m -95.23 126.83 47.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.551 HG22 ' SG ' ' A' ' 8' ' ' CYS . 10.8 p -98.93 118.19 35.15 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.471 ' CE1' HG23 ' A' ' 9' ' ' VAL . 43.4 p90 -131.46 175.59 9.02 Favored 'General case' 0 C--N 1.281 -2.394 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.624 -178.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -107.81 150.34 27.12 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.876 0.735 . . . . 0.0 109.799 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.41 -114.74 4.2 Favored Glycine 0 N--CA 1.42 -2.398 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tt -152.58 -41.08 0.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.541 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -133.49 152.63 51.93 Favored 'General case' 0 CA--C 1.49 -1.364 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.954 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -117.9 127.34 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.574 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.97 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.4 m -63.09 140.29 58.86 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 62' ' ' TYR . 59.5 tp -54.64 -39.23 67.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 124.64 1.176 . . . . 0.0 112.561 -175.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.679 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -54.38 -46.91 73.16 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -74.93 -36.86 62.15 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.821 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.9 -47.34 85.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.721 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.7 mtmt -71.69 -44.92 63.37 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.644 -178.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.679 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.2 mptt -61.38 -35.16 76.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.273 -0.422 . . . . 0.0 112.023 -178.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.39 -49.66 62.97 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 120.481 -0.488 . . . . 0.0 109.891 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -64.97 -42.33 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.971 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 57.4 mtt -59.78 -44.89 93.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.696 0.284 . . . . 0.0 111.237 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.07 -31.01 62.25 Favored Glycine 0 C--N 1.317 -0.491 0 CA-C-O 121.664 0.591 . . . . 0.0 112.058 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.7 ttt85 -69.32 -51.28 38.65 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 123.766 0.826 . . . . 0.0 111.646 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 40.0 mm-40 -92.98 -14.23 27.73 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -172.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp 77.75 72.3 0.06 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 125.657 1.583 . . . . 0.0 111.236 -177.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.9 mp -101.0 153.85 19.19 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.089 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.638 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.96 101.88 14.23 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.02 -12.56 59.69 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.443 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.39 -15.71 57.42 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.23 177.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -117.26 -31.31 5.34 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.588 0.709 . . . . 0.0 110.606 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.0 m -129.2 165.25 21.71 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-O 122.295 1.045 . . . . 0.0 113.787 -172.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.459 ' HB3' HD11 ' A' ' 80' ' ' ILE . 49.5 t0 -123.08 169.66 10.97 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 173.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 35' ' ' LYS . 14.2 tp -115.34 120.09 38.48 Favored 'General case' 0 C--N 1.257 -3.45 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.564 ' HB2' HG12 ' A' ' 80' ' ' ILE . 7.1 tp-100 -106.49 123.45 48.1 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-O 121.267 0.556 . . . . 0.0 109.604 -176.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 77' ' ' VAL . 19.8 mm -114.29 135.43 54.07 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -172.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.5 m -125.89 140.78 52.36 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.601 ' HA ' HG12 ' A' ' 75' ' ' VAL . 9.5 t-20 -72.55 138.22 46.76 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.28 -16.56 34.81 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.436 0.636 . . . . 0.0 110.723 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -99.17 -44.51 6.24 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.842 -173.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -100.38 -19.08 16.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.191 0.519 . . . . 0.0 110.254 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.9 mmmm 71.96 12.45 6.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.051 1.341 . . . . 0.0 112.155 -177.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.1 135.35 46.22 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.059 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -92.86 145.26 24.53 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.296 0.57 . . . . 0.0 110.544 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.432 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 82.3 m-85 -105.18 98.01 7.77 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -90.56 -37.67 13.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.435 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 11.6 t70 -101.17 150.59 22.79 Favored 'General case' 0 CA--C 1.495 -1.17 0 C-N-CA 120.482 -0.487 . . . . 0.0 109.831 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.606 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -64.32 -15.21 59.87 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.435 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -83.08 -11.17 58.25 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -62.19 141.19 58.32 Favored 'General case' 0 C--O 1.19 -2.038 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 -178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.541 HD13 ' CG ' ' A' ' 28' ' ' HIS . 2.8 pp -117.2 137.72 52.17 Favored 'General case' 0 C--N 1.289 -2.065 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.137 -171.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.34 112.53 43.76 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 48.8 Cg_endo -78.0 156.63 30.51 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 C-N-CA 122.803 2.335 . . . . 0.0 112.865 175.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 47.9 pttt -58.24 -17.5 19.7 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.429 0.692 . . . . 0.0 112.535 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -82.71 -1.95 52.8 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.918 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.436 ' HB3' HD21 ' A' ' 55' ' ' ASN . 35.1 m -115.46 118.61 33.67 Favored 'General case' 0 N--CA 1.424 -1.773 0 O-C-N 122.221 -0.3 . . . . 0.0 111.371 -177.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.2 m -89.8 123.21 33.58 Favored 'General case' 0 N--CA 1.425 -1.689 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.601 HG12 ' HA ' ' A' ' 55' ' ' ASN . 25.9 m -121.39 160.03 23.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 CA-C-O 120.945 0.402 . . . . 0.0 111.783 -172.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.7 mm -107.5 133.97 50.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 53' ' ' ILE . 57.3 t -106.44 117.75 52.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.444 -176.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -114.46 137.28 52.04 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -92.74 124.64 36.89 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.548 -0.72 . . . . 0.0 109.666 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.564 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -125.89 149.34 65.66 Favored Pre-proline 0 C--O 1.206 -1.202 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.144 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.79 141.06 33.16 Favored 'Trans proline' 0 C--N 1.32 -0.963 0 C-N-CA 122.297 1.998 . . . . 0.0 111.827 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.437 HG13 ' H ' ' A' ' 83' ' ' GLY . 3.9 pt -69.69 -68.13 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.437 ' H ' HG13 ' A' ' 82' ' ' ILE . . . -168.89 55.73 0.21 Allowed Glycine 0 CA--C 1.49 -1.485 0 C-N-CA 120.023 -1.084 . . . . 0.0 111.411 -178.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -138.42 -79.46 0.07 OUTLIER Glycine 0 CA--C 1.468 -2.892 0 N-CA-C 107.528 -2.229 . . . . 0.0 107.528 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.4 m -77.7 140.49 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 170.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt . . . . . 0 C--N 1.281 -2.38 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.664 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.63 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -93.95 -157.01 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.349 0 C-N-CA 122.97 2.447 . . . . 0.0 107.942 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.55 101.83 0.65 Allowed 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.35 106.88 3.43 Favored Glycine 0 N--CA 1.416 -2.691 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -177.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.0 t -90.43 14.69 12.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.8 ptp -56.95 157.54 5.63 Favored 'General case' 0 CA--C 1.498 -1.056 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.279 176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 73.4 m -127.09 123.32 36.61 Favored 'General case' 0 N--CA 1.392 -3.372 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.899 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.674 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.1 p -139.04 135.66 34.46 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.385 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.596 HG23 ' CE1' ' A' ' 24' ' ' PHE . 69.1 t -105.19 129.57 57.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.561 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -82.97 115.76 21.95 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.91 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.597 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 51.0 p90 -133.66 142.01 47.85 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -120.25 136.99 54.47 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 118.331 -1.348 . . . . 0.0 108.124 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -83.96 174.63 10.18 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -56.55 -37.31 70.35 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.157 0.583 . . . . 0.0 112.482 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.3 m -90.96 1.68 56.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.185 0.517 . . . . 0.0 111.498 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 1.4 mptm? -98.13 127.32 44.0 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.496 0.665 . . . . 0.0 111.615 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.8 tp -91.4 -21.65 20.87 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.964 -1.016 . . . . 0.0 108.341 175.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.22 149.11 46.76 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.011 -1.449 . . . . 0.0 108.954 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -78.16 147.2 34.64 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.422 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 28.4 m-20 -101.11 173.87 6.26 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.9 p -136.15 132.35 35.9 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -102.33 126.15 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 169.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.9 p -94.51 129.54 41.26 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.596 ' CE1' HG23 ' A' ' 9' ' ' VAL . 32.3 p90 -145.99 158.68 43.87 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -95.35 132.9 39.88 Favored 'General case' 0 C--N 1.296 -1.752 0 C-N-CA 119.994 -0.683 . . . . 0.0 111.072 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.92 -146.93 17.39 Favored Glycine 0 N--CA 1.437 -1.297 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.37 -41.95 2.58 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.5 OUTLIER -131.53 152.74 50.49 Favored 'General case' 0 CA--C 1.479 -1.764 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.264 177.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.529 ' HB ' ' CD2' ' A' ' 24' ' ' PHE . 12.4 tt -119.34 126.09 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.732 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.262 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.1 m -55.54 142.31 33.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.492 ' HG ' ' HE2' ' A' ' 35' ' ' LYS . 60.0 tp -58.36 -38.08 76.5 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.749 0.82 . . . . 0.0 112.309 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 35.6 t -56.18 -46.92 79.18 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 30.3 t70 -69.91 -37.89 76.11 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.291 -174.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.07 -46.53 67.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.781 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HE2' ' HG ' ' A' ' 31' ' ' LEU . 51.9 mtmt -66.03 -40.06 90.72 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.357 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -64.02 -35.2 79.93 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 123.552 0.532 . . . . 0.0 111.163 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 94.6 mt-30 -65.0 -47.21 78.33 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.65 -44.73 93.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.258 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 54.5 mtt -60.12 -43.83 95.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.673 0.273 . . . . 0.0 110.465 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -33.12 73.22 Favored Glycine 0 C--N 1.317 -0.525 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.54 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -70.97 -51.25 26.77 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.988 0.423 . . . . 0.0 111.186 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -84.57 -6.59 59.38 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.427 -172.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 7.6 mmmm 67.03 46.97 1.45 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 3.6 tp -83.3 115.61 22.06 Favored 'General case' 0 N--CA 1.411 -2.406 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.095 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.686 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -74.49 109.9 8.35 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-O 121.711 0.767 . . . . 0.0 110.289 177.432 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.31 58.16 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.787 -174.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.91 -1.71 57.56 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.556 0.694 . . . . 0.0 110.125 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.482 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 22.0 t70 -108.99 -51.65 2.86 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.794 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.7 m -140.01 164.62 29.53 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.446 0.641 . . . . 0.0 111.91 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.533 ' HB2' ' HA ' ' A' ' 82' ' ' ILE . 7.4 t70 -108.61 170.57 7.94 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' CG1' ' A' ' 77' ' ' VAL . 17.5 tp -118.58 112.5 19.95 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-O 121.334 0.588 . . . . 0.0 109.847 -172.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.449 ' HB2' HG12 ' A' ' 80' ' ' ILE . 19.0 tt0 -101.91 125.67 48.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.4 mm -113.21 132.7 61.32 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -126.39 141.24 51.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 122.338 -0.226 . . . . 0.0 110.43 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.519 ' HA ' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -59.52 124.24 19.43 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 122.856 0.462 . . . . 0.0 110.79 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.88 -28.91 64.89 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.79 -48.21 7.4 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.474 -0.785 . . . . 0.0 112.898 -175.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.9 p -103.83 -8.04 20.07 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.292 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 59.3 25.13 13.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.71 126.17 30.6 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -91.25 137.71 32.15 Favored 'General case' 0 C--N 1.287 -2.109 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -103.9 106.61 17.17 Favored 'General case' 0 C--N 1.278 -2.503 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.0 p -101.94 -17.9 15.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.021 -175.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.437 ' HB3' HD22 ' A' ' 66' ' ' ASN . 5.2 t70 -106.18 139.78 40.16 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.201 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.676 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -62.75 -16.48 57.93 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 122.886 0.474 . . . . 0.0 111.969 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.437 HD22 ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -77.37 -10.36 59.4 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.472 0.309 . . . . 0.0 111.479 -178.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.21 150.22 47.71 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.514 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.523 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -118.86 138.29 52.84 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 118.655 0.661 . . . . 0.0 111.225 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -121.19 117.17 30.73 Favored Pre-proline 0 C--N 1.316 -0.86 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.507 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 58.7 Cg_endo -76.67 154.89 35.13 Favored 'Trans proline' 0 C--N 1.332 -0.293 0 C-N-CA 123.148 2.565 . . . . 0.0 113.66 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.45 -8.61 55.94 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 122.092 0.949 . . . . 0.0 111.263 178.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -85.18 -1.67 57.16 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.527 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.8 m -119.81 174.58 6.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-O 121.427 0.632 . . . . 0.0 110.947 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.3 m -138.03 139.95 39.86 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 4.5 m -132.56 161.61 41.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 35.3 mm -106.36 131.84 55.06 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.504 ' CG1' HD11 ' A' ' 51' ' ' LEU . 49.7 t -105.06 117.22 50.34 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.198 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -119.71 121.27 38.84 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 121.569 0.7 . . . . 0.0 110.849 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -81.68 118.64 22.99 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.211 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.449 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.59 154.03 66.42 Favored Pre-proline 0 C--O 1.211 -0.946 0 N-CA-C 110.359 -0.237 . . . . 0.0 110.359 -176.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 129.71 28.69 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 C-N-CA 122.364 2.043 . . . . 0.0 111.733 178.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.533 ' HA ' ' HB2' ' A' ' 50' ' ' ASP . 2.8 pt -44.05 -39.24 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -133.49 20.33 4.17 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 119.365 -1.397 . . . . 0.0 112.885 178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.4 -61.84 4.66 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -176.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.9 t -86.26 117.07 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.161 0 N-CA-C 105.685 -1.968 . . . . 0.0 105.685 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt . . . . . 0 C--N 1.286 -2.178 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.917 177.493 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.613 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -66.28 110.11 1.71 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.24 1.96 . . . . 0.0 111.109 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.3 mt -85.09 100.94 12.04 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 147.79 110.21 0.58 Allowed Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.0 t -74.37 -28.27 61.04 Favored 'General case' 0 C--O 1.249 1.05 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 24.9 ptm -71.67 108.67 5.13 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.792 -1.549 . . . . 0.0 108.239 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 23' ' ' THR . 50.9 m -107.63 150.77 26.5 Favored 'General case' 0 C--N 1.253 -3.591 0 CA-C-N 113.64 -1.618 . . . . 0.0 108.104 -173.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.6 p -140.43 136.82 33.44 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.093 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.588 HG23 ' CE1' ' A' ' 24' ' ' PHE . 68.9 t -105.84 128.48 60.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -78.32 113.96 16.79 Favored 'General case' 0 CA--C 1.484 -1.558 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.604 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.3 p90 -135.08 138.38 43.77 Favored 'General case' 0 C--N 1.277 -2.545 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -125.04 136.59 53.83 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 118.615 -1.234 . . . . 0.0 109.788 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.46 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -88.59 170.67 10.65 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 179.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.8 p -66.13 -15.68 63.32 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.303 0.573 . . . . 0.0 112.051 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.5 p -94.57 -11.85 28.65 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 123.215 0.606 . . . . 0.0 111.763 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HG2' ' OD2' ' A' ' 20' ' ' ASP . 0.9 OUTLIER -102.73 133.25 48.09 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 120.9 0.381 . . . . 0.0 110.732 -175.171 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.19 -22.82 22.6 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -127.37 170.82 12.11 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -82.37 133.57 35.23 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.549 ' OD2' ' HG2' ' A' ' 16' ' ' LYS . 20.2 m-20 -83.98 175.88 9.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 171.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -143.09 116.07 8.84 Favored 'General case' 0 C--N 1.292 -1.912 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.146 -177.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -95.21 125.85 47.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.1 p -93.9 123.88 37.54 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-O 121.592 0.711 . . . . 0.0 112.783 -177.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.588 ' CE1' HG23 ' A' ' 9' ' ' VAL . 22.7 p90 -136.35 176.14 8.96 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -178.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.2 148.7 30.51 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.37 -113.15 3.6 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.785 176.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -148.5 -41.32 0.16 Allowed 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -137.33 155.36 49.51 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.95 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.5 tt -126.56 131.77 70.94 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.593 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.238 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 m -63.52 140.28 58.86 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 58.4 tp -55.65 -36.68 67.32 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.566 1.146 . . . . 0.0 112.443 -176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.724 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 18.7 t -54.13 -46.86 72.29 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 13.9 t70 -74.38 -37.82 63.33 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -175.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.4 tm? -58.39 -46.97 85.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.684 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -70.06 -39.88 75.4 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.983 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.724 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -65.11 -37.08 86.33 Favored 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.515 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 89.2 mt-30 -66.36 -45.37 80.39 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.09 -41.06 81.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.911 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.5 mtm -63.95 -37.27 86.79 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.425 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.52 -44.17 41.96 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 120.283 -0.96 . . . . 0.0 111.747 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 25.5 ttt180 -64.84 -49.41 70.68 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' OE2' ' HG2' ' A' ' 41' ' ' ARG . 23.1 mm-40 -92.65 12.99 21.34 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.669 0.271 . . . . 0.0 111.72 -173.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 57.34 47.44 16.64 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.292 1.037 . . . . 0.0 112.166 176.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD2' HD13 ' A' ' 51' ' ' LEU . 9.4 mp -81.81 160.89 23.42 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.975 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -96.96 112.43 24.19 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.62 -13.38 58.03 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.06 -13.71 22.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.727 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.48 ' O ' HG12 ' A' ' 82' ' ' ILE . 14.5 t70 -113.84 -38.52 4.22 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 121.768 0.794 . . . . 0.0 110.73 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.01 174.63 7.47 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.66 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.531 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 23.5 t0 -126.43 166.41 17.25 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 178.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 53' ' ' ILE . 28.5 tp -121.85 113.72 20.04 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -111.59 123.61 50.59 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.976 -175.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.587 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.0 mp -113.41 127.36 70.76 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -173.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.448 ' OG1' ' HG2' ' A' ' 61' ' ' GLU . 29.8 m -122.22 134.57 54.7 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.559 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.1 t-20 -62.71 140.16 58.71 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -21.37 41.42 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.232 0.539 . . . . 0.0 111.68 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -101.14 -48.27 4.47 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.712 -176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.5 p -90.74 -20.04 22.86 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.355 0.597 . . . . 0.0 109.855 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.3 mmmt 64.14 24.1 13.35 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.585 1.154 . . . . 0.0 110.928 -177.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -80.52 125.01 29.43 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.448 ' HG2' ' OG1' ' A' ' 54' ' ' THR . 44.0 mt-10 -86.12 125.72 33.68 Favored 'General case' 0 N--CA 1.402 -2.839 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.78 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HB3' HD22 ' A' ' 31' ' ' LEU . 80.3 m-85 -89.48 94.74 9.99 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.014 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -88.7 -27.35 21.29 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.954 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.99 146.9 27.65 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.691 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.656 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -69.15 -14.33 62.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -81.6 -10.88 59.32 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.102 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.81 143.31 57.95 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.448 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.65 137.55 52.57 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 118.705 0.684 . . . . 0.0 110.762 -175.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.29 118.74 35.41 Favored Pre-proline 0 C--N 1.314 -0.958 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.006 176.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 80.4 Cg_endo -82.64 161.03 16.7 Favored 'Trans proline' 0 C--N 1.326 -0.651 0 C-N-CA 123.478 2.785 . . . . 0.0 113.66 176.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.505 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 40.2 pttt -70.05 -5.84 29.46 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.737 0.779 . . . . 0.0 111.203 175.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -87.65 -1.49 57.99 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.045 177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -124.42 152.91 42.7 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.971 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.9 m -116.23 133.62 55.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.3 m -127.78 156.13 39.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.506 0.67 . . . . 0.0 112.406 -174.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -101.15 128.67 53.18 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 106.622 -1.621 . . . . 0.0 106.622 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.483 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.9 t -108.77 115.29 49.03 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttp-105 -116.52 126.7 53.71 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.46 -174.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -89.82 111.53 22.58 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 pp -111.01 149.99 41.26 Favored Pre-proline 0 C--N 1.297 -1.711 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.8 138.56 13.37 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.724 1.616 . . . . 0.0 112.893 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.531 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 38.1 pt -81.81 -25.45 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 172.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 165.88 -71.78 0.18 Allowed Glycine 0 N--CA 1.408 -3.231 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 177.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.67 174.06 32.12 Favored Glycine 0 N--CA 1.421 -2.347 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.9 m -62.65 126.77 21.58 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-O 121.523 0.678 . . . . 0.0 112.038 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--N 1.3 -1.555 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 178.533 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.985 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -64.08 -31.81 64.85 Favored 'Trans proline' 0 C--O 1.239 0.551 0 C-N-CA 122.825 2.35 . . . . 0.0 112.298 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.33 162.5 13.14 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 96.0 147.79 23.18 Favored Glycine 0 N--CA 1.419 -2.436 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.434 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.9 m -89.38 102.21 14.89 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 87.5 mtp -99.57 -171.05 1.99 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.045 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.593 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 38.6 m -117.03 112.53 21.07 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 64.3 m -139.5 135.45 33.51 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.389 -174.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 21' ' ' THR . 77.5 t -106.82 132.07 55.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -88.1 115.21 25.42 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 46.0 p90 -130.02 130.9 45.55 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 pttp -109.32 139.22 44.55 Favored 'General case' 0 C--N 1.3 -1.577 0 C-N-CA 116.733 -1.987 . . . . 0.0 107.355 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -84.01 165.9 18.21 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.7 m -69.77 -16.99 63.4 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.325 0.583 . . . . 0.0 110.925 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 p -90.59 -13.06 35.2 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 121.367 0.603 . . . . 0.0 110.274 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -105.45 147.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.447 0.642 . . . . 0.0 111.31 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.7 mp -96.89 -30.79 12.93 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -105.89 163.22 12.91 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.394 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -86.89 142.97 27.64 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.363 0.601 . . . . 0.0 111.789 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -108.53 177.37 4.81 Favored 'General case' 0 C--N 1.288 -2.104 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.494 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -143.67 128.05 17.86 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -174.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 1.9 m -95.79 128.61 46.83 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 172.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.423 HG22 ' SG ' ' A' ' 8' ' ' CYS . 21.8 p -94.96 122.41 37.58 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 176.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.593 ' O ' ' HB2' ' A' ' 7' ' ' SER . 21.0 p90 -140.49 171.31 14.32 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -177.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -114.06 122.24 46.27 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.51 -172.32 23.07 Favored Glycine 0 N--CA 1.43 -1.709 0 N-CA-C 108.979 -1.648 . . . . 0.0 108.979 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -96.44 -33.52 11.85 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.173 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.538 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -146.06 151.52 37.86 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.138 -0.937 . . . . 0.0 113.119 -177.515 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -120.29 129.49 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.413 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.968 -178.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -60.96 142.22 56.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.971 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.454 HD22 ' HB3' ' A' ' 62' ' ' TYR . 56.3 tp -55.23 -40.58 71.03 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 124.734 1.214 . . . . 0.0 111.389 -177.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 65' ' ' ASP . 36.0 t -54.14 -46.44 72.23 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.528 0.518 . . . . 0.0 109.808 178.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.1 t70 -74.9 -41.05 60.48 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.861 -176.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -60.53 -44.18 96.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.175 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 51.0 mtmt -65.37 -38.62 90.6 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.436 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 6.0 mptp? -61.63 -37.93 85.78 Favored 'General case' 0 C--O 1.243 0.75 0 O-C-N 123.012 0.195 . . . . 0.0 110.859 177.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 67.6 mm-40 -67.22 -50.39 60.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.14 -43.76 84.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.133 -176.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.9 mtm -63.97 -39.51 94.3 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 122.273 -0.267 . . . . 0.0 111.047 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -42.28 74.23 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.386 177.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.61 -46.46 75.79 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -92.07 2.34 56.63 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt 65.33 53.55 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 124.946 1.298 . . . . 0.0 111.051 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.81 158.26 18.2 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.203 177.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -93.91 100.78 12.88 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-O 122.153 0.978 . . . . 0.0 109.172 175.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.31 60.33 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.991 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.42 -12.25 32.69 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.043 0.449 . . . . 0.0 111.447 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -105.45 -39.76 6.03 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.203 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.11 177.14 7.52 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.733 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.442 ' HB3' HD11 ' A' ' 80' ' ' ILE . 3.3 t70 -127.51 171.17 11.84 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 -178.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 18.2 tp -118.41 125.46 50.02 Favored 'General case' 0 C--N 1.275 -2.667 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.605 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.8 tt0 -114.02 121.94 45.39 Favored 'General case' 0 C--N 1.29 -2.0 0 O-C-N 121.831 -0.543 . . . . 0.0 110.216 -175.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.425 HG13 HG22 ' A' ' 77' ' ' VAL . 2.0 mp -114.08 127.64 71.4 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.977 0 CA-C-O 120.969 0.414 . . . . 0.0 110.809 -175.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.9 m -111.21 144.61 40.09 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.538 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.0 t-20 -80.85 131.39 35.38 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.55 -11.07 58.7 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 120.963 0.411 . . . . 0.0 111.456 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -105.92 -47.92 3.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.006 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.6 p -89.68 -19.19 25.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt 71.85 14.55 5.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.456 1.502 . . . . 0.0 110.678 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -80.68 131.33 35.45 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -95.11 126.75 40.66 Favored 'General case' 0 N--CA 1.408 -2.53 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.49 ' CD1' ' HB1' ' A' ' 67' ' ' ALA . 32.6 m-85 -90.51 101.93 14.66 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -177.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.9 p -101.01 -22.22 14.81 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.161 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.416 ' CG ' HD22 ' A' ' 66' ' ' ASN . 6.5 t70 -103.03 147.61 26.74 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -76.32 -7.83 55.79 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.416 HD22 ' CG ' ' A' ' 64' ' ' ASP . 0.8 OUTLIER -82.74 -10.91 58.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.49 ' HB1' ' CD1' ' A' ' 62' ' ' TYR . . . -62.2 141.46 58.18 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.12 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.538 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -117.53 138.42 51.91 Favored 'General case' 0 C--N 1.29 -2.018 0 O-C-N 121.908 -0.495 . . . . 0.0 111.437 -174.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.27 115.69 42.44 Favored Pre-proline 0 C--N 1.309 -1.162 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.441 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.51 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 54.7 Cg_endo -80.25 153.43 21.41 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.988 2.458 . . . . 0.0 113.592 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 16.1 ptmt -60.35 -20.27 58.79 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.852 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -75.31 -19.56 59.57 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.164 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.414 ' OG ' ' HG2' ' A' ' 70' ' ' PRO . 24.7 m -104.32 139.39 39.37 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-O 121.588 0.709 . . . . 0.0 112.455 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.3 m -97.89 129.38 44.83 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 171.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.611 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -123.95 164.39 22.11 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.5 mt -120.93 130.15 74.95 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 53' ' ' ILE . 23.1 t -102.27 124.39 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.772 -173.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -120.33 145.03 47.52 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.0 ttm105 -100.68 125.85 47.15 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.605 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -129.49 156.29 78.83 Favored Pre-proline 0 C--O 1.217 -0.639 0 C-N-CA 121.249 -0.18 . . . . 0.0 110.83 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -75.97 140.65 23.11 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.079 1.852 . . . . 0.0 110.318 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 17.6 pt -65.48 -45.6 92.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 120.344 -0.542 . . . . 0.0 109.964 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 52.92 44.02 61.45 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.697 -178.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.36 139.33 6.13 Favored Glycine 0 N--CA 1.426 -1.972 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -178.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.5 m -99.71 104.46 16.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 CA-C-O 122.183 0.992 . . . . 0.0 110.954 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.6 pttp . . . . . 0 C--N 1.291 -1.966 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.011 -178.775 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.312 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.28 -170.46 0.8 Allowed 'Trans proline' 0 C--O 1.246 0.894 0 C-N-CA 122.383 2.055 . . . . 0.0 110.407 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.3 tp -56.85 123.96 16.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 113.56 50.38 0.53 Allowed Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 108.458 -1.857 . . . . 0.0 108.458 -171.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.2 m -109.15 14.94 23.62 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp 64.25 -170.87 0.18 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.028 -1.442 . . . . 0.0 110.393 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.6 m -132.32 122.25 24.81 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.5 p -148.43 143.33 26.7 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.834 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.481 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.6 t -106.26 131.94 54.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -77.56 112.32 14.22 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 124.056 0.848 . . . . 0.0 108.749 174.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.637 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -132.31 141.47 48.98 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -120.54 142.46 49.31 Favored 'General case' 0 C--N 1.297 -1.696 0 C-N-CA 117.77 -1.572 . . . . 0.0 108.473 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.555 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -84.5 157.38 21.32 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 176.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -55.58 -31.0 61.82 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.254 0.622 . . . . 0.0 112.601 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -122.43 16.63 10.51 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.123 0.487 . . . . 0.0 111.106 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 16.1 tptm -86.13 -29.03 23.61 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.6 tp 74.04 -52.78 0.69 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.102 1.761 . . . . 0.0 112.174 177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -98.75 152.61 19.49 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.081 -178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -74.95 142.86 43.9 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.915 0.864 . . . . 0.0 112.274 -178.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -115.24 178.74 4.18 Favored 'General case' 0 C--N 1.279 -2.469 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -140.4 117.36 11.11 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-O 120.866 0.365 . . . . 0.0 110.289 -174.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 13.0 p -95.37 118.7 42.17 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.4 p -85.66 127.33 34.46 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.974 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 7' ' ' SER . 32.9 p90 -142.35 176.29 9.11 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -114.68 144.67 43.06 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.26 -179.14 19.8 Favored Glycine 0 C--N 1.306 -1.137 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -175.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -87.22 -33.36 19.35 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 118.03 0.915 . . . . 0.0 109.068 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.536 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -138.1 159.88 40.87 Favored 'General case' 0 CA--C 1.484 -1.576 0 CA-C-N 114.746 -1.116 . . . . 0.0 112.119 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.2 tt -128.28 128.53 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.098 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.536 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.6 m -62.66 147.03 50.65 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.256 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.73 -42.19 88.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 123.972 0.909 . . . . 0.0 112.697 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.586 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 33.7 t -56.5 -45.55 80.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.46 -45.78 82.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.909 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.36 -46.57 82.85 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.912 -176.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.8 mtmt -64.17 -41.18 97.24 Favored 'General case' 0 C--O 1.207 -1.139 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -62.94 -37.24 86.25 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -62.59 -50.62 70.54 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.025 0.441 . . . . 0.0 109.831 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.77 -47.8 68.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.87 -176.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.417 ' HG3' HD22 ' A' ' 51' ' ' LEU . 71.6 mtm -65.8 -33.59 76.21 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.43 35.71 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 119.211 -1.471 . . . . 0.0 111.16 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -59.63 -50.86 72.22 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.521 0.728 . . . . 0.0 111.931 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 7.7 mm-40 -92.72 0.22 57.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.266 0.555 . . . . 0.0 110.338 -174.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 60.75 70.93 0.59 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.69 1.196 . . . . 0.0 112.686 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.473 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.3 mp -103.97 144.2 31.84 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.526 -1.216 . . . . 0.0 108.899 175.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 7.0 ptpp? -92.9 103.49 15.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.972 0.892 . . . . 0.0 111.331 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.95 -16.48 62.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.43 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.04 1.75 51.88 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.308 0.575 . . . . 0.0 110.994 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.487 ' O ' HG12 ' A' ' 82' ' ' ILE . 26.0 t70 -122.16 -36.72 2.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.608 0.718 . . . . 0.0 109.955 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -135.44 153.61 51.72 Favored 'General case' 0 N--CA 1.42 -1.951 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.717 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.486 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 27.0 t0 -108.6 159.92 16.34 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.6 tp -107.68 107.95 18.98 Favored 'General case' 0 C--N 1.267 -2.989 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HB2' HG12 ' A' ' 80' ' ' ILE . 31.8 tt0 -103.43 108.96 20.42 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.908 0.861 . . . . 0.0 109.123 -173.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.484 HD12 HG22 ' A' ' 77' ' ' VAL . 25.3 mm -94.56 135.42 28.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.314 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 24.3 m -118.8 149.33 41.69 Favored 'General case' 0 C--N 1.281 -2.4 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.502 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.7 t-20 -72.49 139.69 47.79 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.45 -26.25 51.3 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.144 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -92.74 -58.15 2.44 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.449 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.9 p -87.94 -16.61 33.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.152 0.501 . . . . 0.0 110.67 -171.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 63.71 21.79 12.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.091 0.956 . . . . 0.0 111.489 -177.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -75.46 130.4 38.86 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.1 mt-10 -87.44 137.49 32.29 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-O 121.097 0.475 . . . . 0.0 110.665 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -103.77 103.0 12.84 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -106.39 -19.96 13.53 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.922 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -90.21 133.62 34.8 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.502 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.5 m-20 -66.96 -13.25 61.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 120.801 0.334 . . . . 0.0 111.881 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -85.43 -6.19 59.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.32 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.28 141.77 58.64 Favored 'General case' 0 C--O 1.208 -1.117 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.536 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.96 137.63 52.71 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -177.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.72 115.45 35.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.278 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -77.71 155.85 31.28 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.042 2.495 . . . . 0.0 113.254 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 53.5 pttt -69.71 -8.14 45.3 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.536 0.684 . . . . 0.0 111.447 178.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -81.56 -17.7 47.48 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.383 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.5 m -105.71 158.72 16.52 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.879 -177.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 m -119.62 136.86 54.21 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.637 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -130.9 166.24 29.09 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 CA-C-O 121.078 0.466 . . . . 0.0 111.102 -175.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.5 mt -120.03 130.57 74.11 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.858 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.484 HG22 HD12 ' A' ' 53' ' ' ILE . 57.6 t -102.01 122.47 54.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.005 -173.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -127.51 128.13 45.16 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 47.6 ttp180 -88.1 125.85 34.8 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.495 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -122.68 142.18 36.98 Favored Pre-proline 0 N--CA 1.439 -0.988 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -75.13 128.53 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.481 0 C-N-CA 122.261 1.974 . . . . 0.0 110.847 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ASP . 23.9 pt -72.1 -30.73 37.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.541 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.62 -20.73 61.21 Favored Glycine 0 N--CA 1.441 -1.02 0 C-N-CA 120.209 -0.996 . . . . 0.0 111.193 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.81 -55.29 3.19 Favored Glycine 0 N--CA 1.434 -1.461 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 48.1 t -94.19 95.52 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.2 mttp . . . . . 0 C--N 1.3 -1.555 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.199 -178.178 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.276 0 CA-C-O 119.163 -0.798 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -56.35 -50.39 12.17 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 123.614 2.876 . . . . 0.0 112.609 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.96 -47.39 9.01 Favored 'General case' 0 CA--C 1.485 -1.521 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 175.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.0 -100.47 0.22 Allowed Glycine 0 N--CA 1.398 -3.875 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.374 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 m 58.39 35.64 24.92 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 -174.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -62.98 154.04 31.81 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.183 -1.826 . . . . 0.0 113.035 -171.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.8 m -127.4 134.25 49.92 Favored 'General case' 0 N--CA 1.403 -2.795 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.909 -177.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 14.5 p -146.37 140.19 26.18 Favored 'General case' 0 N--CA 1.418 -2.043 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.513 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.537 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.9 t -107.74 124.66 63.98 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.256 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -73.62 105.35 4.91 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 124.203 0.939 . . . . 0.0 108.893 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -124.97 133.39 53.03 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -108.31 134.73 50.73 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 117.205 -1.798 . . . . 0.0 108.283 174.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.481 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 1.2 t80 -97.88 161.79 13.56 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.161 -2.162 . . . . 0.0 105.161 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 t -59.71 -26.29 65.5 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 t -87.86 -12.0 46.12 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.175 0.512 . . . . 0.0 110.833 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 2.8 mptp? -96.18 133.09 40.91 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 177.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -86.68 -22.76 25.89 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.3 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.505 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 18.7 m120 -120.42 168.62 11.12 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.572 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -76.5 144.67 39.64 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.644 0.735 . . . . 0.0 112.122 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -104.85 177.88 4.72 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -141.77 113.68 7.96 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 118.716 0.689 . . . . 0.0 112.006 -174.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.61 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.16 136.61 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.9 p -108.24 145.47 34.26 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -174.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.537 ' HE1' HG23 ' A' ' 9' ' ' VAL . 30.1 p90 -158.71 157.36 31.63 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.12 115.35 28.84 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 118.224 0.465 . . . . 0.0 109.78 175.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.23 175.6 14.97 Favored Glycine 0 C--N 1.284 -2.345 0 N-CA-C 108.205 -1.958 . . . . 0.0 108.205 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.0 tp -85.43 -32.86 22.1 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 118.409 1.105 . . . . 0.0 110.774 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -145.5 151.24 37.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -177.247 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.9 131.37 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.039 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.622 -177.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.1 m -61.84 148.05 44.55 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 123.122 0.569 . . . . 0.0 110.376 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 124.059 0.944 . . . . 0.0 111.394 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.63 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 49.5 t -55.59 -46.13 77.32 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -69.71 -44.33 70.57 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.261 0.553 . . . . 0.0 110.289 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.43 -45.82 89.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.09 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.0 mtmt -62.7 -42.96 99.91 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.922 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.3 mptp? -61.47 -35.44 77.64 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 120.753 0.311 . . . . 0.0 111.123 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -69.85 -42.71 73.19 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.455 ' O ' ' HB3' ' A' ' 41' ' ' ARG . 66.3 mt -74.34 -36.21 41.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.691 0.281 . . . . 0.0 111.444 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.505 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.5 mtt -62.45 -46.0 90.49 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.83 -38.67 93.16 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.258 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 25.8 tpt180 -54.62 -50.24 68.57 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.552 1.541 . . . . 0.0 110.925 178.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 67.1 mm-40 -100.58 6.29 44.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -176.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.407 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 63.96 36.23 10.21 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.591 0.756 . . . . 0.0 111.999 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.435 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.3 mp -66.74 154.05 41.72 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.599 0.714 . . . . 0.0 112.382 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 19.9 ptmt -98.44 106.88 19.22 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.652 173.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.83 -6.06 55.06 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.231 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.96 -5.5 59.23 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.904 177.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.544 ' O ' HG12 ' A' ' 82' ' ' ILE . 17.9 t70 -128.88 -42.36 1.41 Allowed 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.511 0.672 . . . . 0.0 109.756 176.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.409 ' C ' HG23 ' A' ' 82' ' ' ILE . 71.5 m -120.62 157.58 29.23 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.513 ' HB2' HG22 ' A' ' 82' ' ' ILE . 41.6 t0 -113.46 169.34 9.03 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' HD11 ' A' ' 53' ' ' ILE . 15.7 tp -119.62 113.41 20.65 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 119.756 -0.778 . . . . 0.0 108.953 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.627 HE21 HG21 ' A' ' 80' ' ' ILE . 9.3 tt0 -106.53 120.5 42.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.049 -177.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.471 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.1 mm -106.5 135.68 43.96 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.7 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 23.4 m -117.28 151.06 37.73 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 175.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.596 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -78.03 145.71 35.75 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 175.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.29 -21.86 24.2 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.304 0.573 . . . . 0.0 110.861 -178.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -96.75 -48.87 5.31 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.579 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 35.9 p -93.77 -21.89 19.03 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.02 0.438 . . . . 0.0 110.353 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 68.3 19.36 9.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.037 1.335 . . . . 0.0 112.139 -175.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.51 125.8 27.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 36.9 mt-10 -87.73 127.48 35.31 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.224 0.535 . . . . 0.0 110.785 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -93.04 100.95 13.28 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.0 p -99.19 -35.86 9.85 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.646 -176.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -85.88 135.71 33.59 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -66.8 -12.45 58.96 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -90.91 -1.42 57.84 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.867 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.92 148.29 51.77 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.62 137.63 53.14 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 118.393 0.542 . . . . 0.0 110.689 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -115.87 118.45 38.58 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.968 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.41 ' CA ' ' HB3' ' A' ' 28' ' ' HIS . 83.3 Cg_endo -83.62 157.5 14.18 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.097 2.532 . . . . 0.0 112.982 176.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG2' ' CB ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -72.74 3.26 5.3 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 122.495 1.141 . . . . 0.0 110.78 176.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -87.68 -18.55 29.28 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.05 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.7 m -116.31 151.59 35.56 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.355 0.598 . . . . 0.0 111.74 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.2 t -105.96 137.63 43.53 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 176.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 29.4 m -128.46 159.65 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-O 121.648 0.737 . . . . 0.0 112.781 -177.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.3 mm -109.42 126.29 66.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.452 HG22 HD12 ' A' ' 53' ' ' ILE . 61.4 t -101.4 123.26 54.38 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.283 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 ttp-105 -122.94 124.48 43.29 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.225 0.536 . . . . 0.0 109.856 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -83.59 120.33 25.83 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.627 HG21 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -124.66 153.84 70.06 Favored Pre-proline 0 C--O 1.201 -1.471 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.86 138.76 38.25 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.07 1.847 . . . . 0.0 111.947 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 48' ' ' ASP . 11.3 pt -68.12 -31.73 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-O 121.558 0.694 . . . . 0.0 110.478 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 143.7 29.6 0.11 Allowed Glycine 0 N--CA 1.428 -1.835 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.404 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.78 165.12 13.83 Favored Glycine 0 N--CA 1.426 -1.985 0 N-CA-C 108.968 -1.653 . . . . 0.0 108.968 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.8 p -76.57 113.1 15.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 CA-C-O 121.855 0.836 . . . . 0.0 109.505 178.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.2 mttm . . . . . 0 C--N 1.297 -1.685 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.854 -176.913 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.359 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.42 134.97 23.54 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 122.305 2.003 . . . . 0.0 112.483 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.3 mt -72.83 -41.22 65.09 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.93 171.57 37.03 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.1 t 57.47 80.45 0.17 Allowed 'General case' 0 C--O 1.242 0.676 0 C-N-CA 123.552 0.741 . . . . 0.0 111.174 179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.7 mtp -69.63 133.53 47.68 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' THR . 70.8 m -79.39 115.45 19.04 Favored 'General case' 0 N--CA 1.397 -3.099 0 CA-C-O 121.673 0.749 . . . . 0.0 111.891 -171.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.2 p -140.38 132.79 28.45 Favored 'General case' 0 N--CA 1.399 -3.023 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.04 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.595 HG23 ' HE1' ' A' ' 24' ' ' PHE . 43.5 t -107.11 127.96 62.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.53 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 62.7 m-70 -79.66 105.64 11.1 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 174.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.2 p90 -118.0 142.3 47.52 Favored 'General case' 0 C--N 1.28 -2.426 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -123.65 124.27 42.39 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 118.77 -1.172 . . . . 0.0 110.199 174.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -80.32 157.89 26.26 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 177.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 m -56.89 -37.68 71.72 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.042 0.448 . . . . 0.0 110.229 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 p -88.06 -8.59 55.32 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.43 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB2' ' CB ' ' A' ' 13' ' ' PHE . 31.5 tptt -83.37 -37.73 22.93 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 tt 73.65 -51.78 0.7 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 125.726 1.61 . . . . 0.0 109.571 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -100.18 170.01 8.75 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -88.2 155.66 19.64 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 121.22 0.533 . . . . 0.0 111.095 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.6 t70 -128.33 178.53 6.2 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -133.78 117.88 17.4 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 119.366 0.984 . . . . 0.0 112.258 -173.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.4 p -99.9 123.14 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.7 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 7' ' ' SER . 36.1 p -92.03 143.06 26.85 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.968 -177.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HE1' HG23 ' A' ' 9' ' ' VAL . 41.4 p90 -154.6 172.23 18.18 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.681 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.59 133.0 43.56 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.229 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.85 178.59 21.58 Favored Glycine 0 C--N 1.292 -1.915 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.03 -33.96 19.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -137.78 164.1 29.74 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.011 -179.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.0 tt -134.1 131.08 55.44 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.548 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m -63.58 143.16 58.06 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.9 tp -54.54 -40.08 68.32 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.27 1.428 . . . . 0.0 113.351 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.533 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.5 t -55.96 -45.89 78.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.719 0.295 . . . . 0.0 110.539 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.88 -41.73 70.97 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.26 -46.13 85.05 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.978 -177.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 39' ' ' MET . 54.7 mtmt -61.73 -42.56 99.12 Favored 'General case' 0 C--O 1.206 -1.199 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.45 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.75 -35.11 77.15 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.27 0.356 . . . . 0.0 111.849 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -70.64 -45.68 64.72 Favored 'General case' 0 C--O 1.21 -1.009 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.109 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.4 -38.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.846 0.355 . . . . 0.0 111.348 -178.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.5 mtt -63.7 -38.99 93.2 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.6 -31.8 60.24 Favored Glycine 0 C--O 1.219 -0.833 0 N-CA-C 111.771 -0.531 . . . . 0.0 111.771 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.507 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 24.9 tpt180 -64.59 -51.36 63.15 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 124.818 1.247 . . . . 0.0 110.865 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -94.63 -17.95 21.82 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 80.4 70.14 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 125.811 1.645 . . . . 0.0 111.825 -176.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -97.55 165.93 11.75 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 114.803 -1.089 . . . . 0.0 111.793 176.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -107.19 101.79 11.16 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.235 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.77 -13.98 60.66 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.925 -173.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.52 2.38 56.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.721 0.772 . . . . 0.0 110.374 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -119.21 -36.26 3.42 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.742 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.3 p -139.22 162.48 34.89 Favored 'General case' 0 C--N 1.297 -1.695 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.806 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.457 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 40.4 t0 -114.6 166.58 11.58 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HG ' HD11 ' A' ' 53' ' ' ILE . 16.1 tp -117.33 105.54 12.28 Favored 'General case' 0 C--N 1.263 -3.153 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -174.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.439 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.6 tp60 -90.93 123.42 34.41 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 -175.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.427 HD11 ' HG ' ' A' ' 51' ' ' LEU . 27.8 mm -110.84 135.22 50.62 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.571 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.0 m -123.19 140.73 52.72 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.9 t-20 -71.52 139.68 49.62 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.88 -29.66 55.88 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.631 0.729 . . . . 0.0 110.687 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -94.32 -49.64 5.62 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.127 -173.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.4 p -93.18 -18.23 22.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.291 0.567 . . . . 0.0 109.475 -175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 42.0 mmtm 65.15 22.55 12.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.603 1.161 . . . . 0.0 112.242 -177.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -78.06 129.26 35.02 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -83.73 136.89 34.0 Favored 'General case' 0 N--CA 1.412 -2.373 0 CA-C-O 121.336 0.588 . . . . 0.0 109.595 176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.44 ' HD1' ' HB1' ' A' ' 67' ' ' ALA . 89.7 m-85 -96.13 98.73 10.57 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 3.2 p -91.8 -40.98 10.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -175.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -91.87 147.45 22.96 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 13.5 m-20 -66.06 -16.03 63.58 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.887 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -88.96 -1.33 58.05 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.201 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.44 ' HB1' ' HD1' ' A' ' 62' ' ' TYR . . . -66.42 145.4 55.72 Favored 'General case' 0 C--O 1.209 -1.076 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.451 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.06 137.73 52.71 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 119.928 -0.709 . . . . 0.0 112.696 -172.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.13 117.97 40.75 Favored Pre-proline 0 C--N 1.312 -1.024 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.87 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 64.4 Cg_endo -81.83 154.48 17.58 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.083 2.522 . . . . 0.0 112.827 174.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.557 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.17 -10.72 56.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -87.76 -2.05 58.36 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.319 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 55.2 m -106.92 140.0 40.42 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.302 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 m -100.0 131.67 45.82 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 172.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 55' ' ' ASN . 27.0 m -125.88 159.86 33.48 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -176.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 mm -105.07 135.34 43.5 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 45.5 t -111.73 117.66 55.67 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-O 120.973 0.416 . . . . 0.0 110.085 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -119.38 122.9 42.84 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.407 0.683 . . . . 0.0 109.993 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -77.97 121.6 24.41 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.439 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.37 146.72 45.55 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.867 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.03 135.47 23.15 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.344 2.029 . . . . 0.0 111.043 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.457 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.8 pt -80.57 -27.69 11.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.1 -79.65 1.69 Allowed Glycine 0 N--CA 1.419 -2.455 0 N-CA-C 108.781 -1.727 . . . . 0.0 108.781 -173.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.22 41.29 0.45 Allowed Glycine 0 N--CA 1.418 -2.553 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.027 178.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 38.5 t -78.63 86.7 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -177.55 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.989 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.11 125.53 18.38 Favored 'Trans proline' 0 C--O 1.244 0.798 0 C-N-CA 122.737 2.291 . . . . 0.0 110.811 176.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.6 mt -101.42 142.97 32.02 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.15 -38.94 24.77 Favored Glycine 0 N--CA 1.436 -1.342 0 N-CA-C 111.277 -0.729 . . . . 0.0 111.277 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m 62.54 27.41 16.22 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.279 1.031 . . . . 0.0 110.733 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 92.5 mmm 55.94 98.67 0.02 OUTLIER 'General case' 0 CA--C 1.494 -1.174 0 C-N-CA 124.709 1.204 . . . . 0.0 111.475 -171.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.586 ' O ' ' HA ' ' A' ' 23' ' ' THR . 3.3 m -63.17 120.24 11.12 Favored 'General case' 0 C--N 1.281 -2.37 0 CA-C-N 112.863 -1.971 . . . . 0.0 108.021 -175.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.3 p -138.11 134.17 34.31 Favored 'General case' 0 N--CA 1.419 -2.007 0 C-N-CA 119.542 -0.863 . . . . 0.0 111.855 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' CE1' ' A' ' 24' ' ' PHE . 74.5 t -106.67 125.59 62.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 175.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -77.82 119.75 21.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.658 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 43.1 p90 -133.98 138.55 45.51 Favored 'General case' 0 C--N 1.286 -2.176 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -118.46 146.12 44.73 Favored 'General case' 0 N--CA 1.426 -1.649 0 C-N-CA 118.433 -1.307 . . . . 0.0 107.678 173.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -92.87 169.4 10.49 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -63.7 -16.68 61.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.901 0.857 . . . . 0.0 110.708 174.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.0 m -138.15 107.85 6.25 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 171.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -177.81 -39.23 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.0 tp 76.71 -52.53 0.58 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.905 1.682 . . . . 0.0 111.136 -178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -102.01 172.65 6.79 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -94.99 143.38 26.52 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-O 121.24 0.543 . . . . 0.0 109.672 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -104.6 177.76 4.75 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 175.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.13 116.29 9.44 Favored 'General case' 0 C--N 1.275 -2.642 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -173.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 15.0 p -95.16 116.94 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.782 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.586 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.2 p -89.42 124.36 34.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-O 121.587 0.708 . . . . 0.0 112.201 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.461 ' CE1' HG23 ' A' ' 9' ' ' VAL . 31.6 p90 -132.92 177.17 7.86 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -176.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -113.8 136.1 53.23 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.95 174.48 17.17 Favored Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -82.12 -35.58 28.38 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.503 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -135.08 159.24 42.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -179.753 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.4 tt -127.4 126.14 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.572 -178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.0 m -59.74 141.36 55.35 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.957 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.459 HD11 ' CG1' ' A' ' 53' ' ' ILE . 56.8 tp -55.24 -40.91 71.43 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 123.973 0.909 . . . . 0.0 112.045 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.734 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 9.3 t -56.3 -46.66 79.71 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 12.8 t70 -68.05 -43.92 77.57 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 -177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.22 -46.61 89.71 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.883 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 44.2 mtmt -67.13 -40.48 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.707 0.289 . . . . 0.0 110.645 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.3 mptt -65.03 -34.09 77.61 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.093 178.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.6 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 83.2 mm-40 -62.13 -49.95 73.84 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.353 0.596 . . . . 0.0 109.495 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.3 mt -67.76 -47.85 78.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.627 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 67.1 mtm -63.33 -37.24 86.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.853 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.43 61.89 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.154 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -72.39 -49.55 33.01 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 122.628 0.371 . . . . 0.0 111.548 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 44.2 mt-10 -93.45 -1.74 55.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -175.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 18.9 mmtp 71.75 45.02 0.45 Allowed 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.411 1.085 . . . . 0.0 111.225 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.7 mp -73.34 162.99 28.71 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.942 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.46 100.28 12.86 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.133 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.07 -14.73 58.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.887 -173.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.68 -4.39 23.83 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.878 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -103.1 -42.55 5.74 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.972 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.4 m -133.65 166.17 23.24 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.7 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -108.13 162.14 14.33 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.524 HD11 ' CG1' ' A' ' 77' ' ' VAL . 33.1 tp -107.44 125.05 50.75 Favored 'General case' 0 C--N 1.251 -3.674 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.603 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.2 tt0 -110.67 128.93 55.91 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 -178.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD11 ' A' ' 31' ' ' LEU . 44.7 mm -113.31 133.62 58.62 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.196 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -176.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 22.8 m -116.71 153.39 32.46 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 176.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 14.3 t-20 -83.86 146.51 28.05 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.08 -12.45 28.48 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.267 0.556 . . . . 0.0 111.187 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -103.76 -39.64 6.58 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.096 -176.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -100.04 -25.11 14.42 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.8 mmmm 68.84 24.93 6.33 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.099 1.359 . . . . 0.0 111.131 -176.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -90.24 135.51 33.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.731 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 18.4 mp0 -78.81 141.53 37.67 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 121.043 0.449 . . . . 0.0 110.959 175.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -103.21 99.4 9.25 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 173.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 p -82.22 -31.18 30.42 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' HD23 ' A' ' 31' ' ' LEU . 2.2 m-20 -105.87 139.42 40.46 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.608 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -63.19 -7.25 5.51 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.066 0.946 . . . . 0.0 111.454 178.179 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -90.63 -0.16 57.59 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.368 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.04 152.05 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.503 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.76 137.35 53.42 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 118.21 0.459 . . . . 0.0 110.36 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -116.34 117.3 38.75 Favored Pre-proline 0 C--N 1.304 -1.386 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.652 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.7 Cg_endo -79.77 159.7 24.72 Favored 'Trans proline' 0 C--N 1.323 -0.779 0 C-N-CA 122.936 2.424 . . . . 0.0 112.683 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.1 pttt -70.59 1.01 5.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.486 0.66 . . . . 0.0 111.327 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -87.81 -11.26 48.49 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.8 m -122.21 149.35 43.79 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 121.389 0.614 . . . . 0.0 112.56 -172.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 m -103.43 133.28 48.75 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.658 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 19.2 m -126.25 169.78 17.18 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 CA-C-O 120.924 0.392 . . . . 0.0 111.026 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.1 mt -123.95 136.11 61.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 123.704 0.802 . . . . 0.0 109.012 -177.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.524 ' CG1' HD11 ' A' ' 51' ' ' LEU . 26.3 t -106.23 128.58 60.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.472 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -136.73 133.4 36.04 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -177.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -89.62 132.42 35.13 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.603 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -131.44 152.65 80.85 Favored Pre-proline 0 C--N 1.314 -0.957 0 CA-C-N 118.215 0.461 . . . . 0.0 110.318 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.77 128.8 17.5 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 121.795 1.663 . . . . 0.0 110.875 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.4 pt -50.69 -44.53 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 CA-C-O 121.073 0.463 . . . . 0.0 111.846 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -127.53 -51.98 0.14 Allowed Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 163.89 -75.3 0.17 Allowed Glycine 0 CA--C 1.472 -2.625 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 28.3 m -72.74 135.34 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 172.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.8 pttp . . . . . 0 C--N 1.284 -2.277 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -171.769 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.45 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -86.35 168.19 8.85 Favored 'Trans proline' 0 C--O 1.248 1.011 0 C-N-CA 122.962 2.442 . . . . 0.0 112.123 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.4 tp -68.62 -32.66 72.69 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.74 38.41 2.94 Favored Glycine 0 CA--C 1.524 0.647 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.49 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.0 t -67.19 -45.07 78.01 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.213 1.006 . . . . 0.0 109.573 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 95.7 mmm -91.91 -179.82 5.4 Favored 'General case' 0 C--N 1.273 -2.725 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.807 178.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HA ' ' A' ' 23' ' ' THR . 41.9 m -96.22 127.06 41.89 Favored 'General case' 0 C--N 1.275 -2.665 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.797 -175.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.608 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.1 p -148.53 135.19 19.78 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.357 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.584 HG23 ' CE1' ' A' ' 24' ' ' PHE . 98.3 t -107.06 134.43 48.78 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -84.0 109.68 17.83 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 34.5 p90 -127.82 138.97 52.9 Favored 'General case' 0 C--N 1.277 -2.555 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -121.03 137.52 54.61 Favored 'General case' 0 C--N 1.281 -2.398 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.4 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.5 t80 -90.42 156.77 17.98 Favored 'General case' 0 C--N 1.283 -2.29 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.6 m -56.92 -29.19 62.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.899 0.381 . . . . 0.0 111.007 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.6 m -83.76 -10.96 57.74 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.311 0.644 . . . . 0.0 111.813 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -101.19 156.98 17.11 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 122.107 -0.37 . . . . 0.0 110.873 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.9 mt -97.56 -43.24 7.31 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.736 0.779 . . . . 0.0 108.949 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -114.54 167.64 10.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.394 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -76.12 149.1 37.44 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.948 0.88 . . . . 0.0 112.779 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -112.16 177.11 4.75 Favored 'General case' 0 C--N 1.28 -2.441 0 N-CA-C 105.126 -2.175 . . . . 0.0 105.126 174.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -140.18 113.53 8.49 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 118.612 0.642 . . . . 0.0 110.354 -174.035 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 12.2 p -96.3 124.07 48.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.402 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.527 ' HA ' ' O ' ' A' ' 7' ' ' SER . 13.3 p -87.3 140.07 29.92 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.648 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.584 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.0 p90 -148.08 167.36 25.18 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 120.987 0.423 . . . . 0.0 110.736 -178.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -101.63 116.15 32.1 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.611 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.42 177.07 15.46 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 110.435 -1.066 . . . . 0.0 110.435 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.3 tp -77.52 -30.98 53.14 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 122.021 0.915 . . . . 0.0 109.529 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.61 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.76 158.72 43.46 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.533 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 tt -124.53 128.1 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.103 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 m -62.1 142.3 57.65 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.944 175.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 58.2 tp -54.41 -39.87 67.71 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 125.301 1.441 . . . . 0.0 112.262 -176.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.557 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -55.83 -46.19 78.18 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 123.24 0.337 . . . . 0.0 110.602 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.1 t70 -73.34 -39.08 65.49 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -175.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.76 -46.19 89.19 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.05 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 53.4 mtmt -66.32 -39.76 89.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.0 mptp? -61.71 -40.35 94.72 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.275 178.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 64.6 mt-30 -66.9 -50.32 62.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.445 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.72 -43.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.631 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.55 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 71.1 mtm -64.27 -45.07 89.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.74 -178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.38 -33.89 61.09 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.965 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 41' ' ' ARG . 35.3 ttt180 -75.09 -46.75 32.56 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 32.2 mm-40 -94.24 13.13 24.36 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp 68.16 34.04 4.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.518 1.127 . . . . 0.0 111.873 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 10.5 mp -74.62 174.19 9.39 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.172 0.987 . . . . 0.0 112.819 -178.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.613 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 13.2 ptpt -109.82 108.28 18.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.618 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.37 -20.71 31.52 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -175.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -107.04 -15.13 14.76 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.947 0.403 . . . . 0.0 111.343 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.613 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . 14.4 t70 -92.56 -27.66 17.23 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -176.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.672 ' SG ' ' HA ' ' A' ' 86' ' ' LYS . 73.4 m -147.94 167.51 24.66 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -110.87 169.5 8.72 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.472 HD11 HG12 ' A' ' 77' ' ' VAL . 31.2 tp -127.52 119.78 26.8 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -175.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HB2' HG12 ' A' ' 80' ' ' ILE . 39.4 tt0 -121.63 136.98 54.92 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -115.39 135.62 54.79 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.904 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -176.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 m -121.51 146.03 47.35 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.541 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -74.64 137.22 42.1 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.77 43.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.364 0.602 . . . . 0.0 111.205 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -100.06 -52.84 3.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.929 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.3 p -92.23 -16.59 25.97 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.6 mmmm 68.41 17.13 9.19 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.749 1.219 . . . . 0.0 111.463 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -81.4 132.42 35.32 Favored 'General case' 0 N--CA 1.433 -1.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -83.85 146.71 27.95 Favored 'General case' 0 N--CA 1.415 -2.195 0 CA-C-O 121.577 0.703 . . . . 0.0 110.416 178.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.424 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 79.7 m-85 -107.22 103.83 13.3 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -100.38 -36.99 9.04 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -88.61 140.01 29.89 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.546 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 2.0 m-20 -68.61 -10.79 58.17 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -88.83 -4.45 58.49 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.035 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.424 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -63.73 142.89 58.24 Favored 'General case' 0 C--O 1.208 -1.095 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.61 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -117.14 137.79 52.08 Favored 'General case' 0 C--N 1.283 -2.315 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.586 -173.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.62 117.87 37.54 Favored Pre-proline 0 C--N 1.306 -1.323 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 91.2 Cg_endo -81.3 160.22 20.09 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 123.233 2.622 . . . . 0.0 114.063 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -67.96 -9.19 43.37 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.889 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -87.91 -1.57 58.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.423 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.9 m -121.01 157.34 30.2 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 121.406 0.622 . . . . 0.0 112.233 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 m -115.06 130.83 57.03 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 174.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.4 m -127.26 160.22 36.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.46 0.647 . . . . 0.0 112.694 -175.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.4 mm -104.0 123.86 58.01 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 51' ' ' LEU . 40.6 t -104.43 120.12 54.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -127.13 130.51 49.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.239 -172.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -83.52 120.93 26.54 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.63 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -117.59 156.62 49.22 Favored Pre-proline 0 C--N 1.313 -0.985 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.735 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 26.0 Cg_endo -64.32 131.09 28.87 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.231 1.954 . . . . 0.0 112.798 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 pt -64.0 -24.57 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 CA-C-O 121.635 0.731 . . . . 0.0 109.616 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -162.05 -58.78 0.02 OUTLIER Glycine 0 N--CA 1.425 -2.042 0 N-CA-C 107.375 -2.29 . . . . 0.0 107.375 174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.402 ' H ' ' H ' ' A' ' 85' ' ' VAL . . . -140.62 -28.08 0.2 Allowed Glycine 0 N--CA 1.431 -1.682 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 81' ' ' PRO . 7.2 t -69.43 115.78 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-O 121.301 0.572 . . . . 0.0 109.807 178.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.672 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 2.4 pptp? . . . . . 0 C--N 1.289 -2.035 0 C-N-CA 125.821 1.649 . . . . 0.0 106.735 175.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.605 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -82.57 41.86 1.19 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.364 2.709 . . . . 0.0 112.676 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 pp -130.39 160.11 35.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.716 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.99 56.17 4.82 Favored Glycine 0 CA--C 1.517 0.203 0 CA-C-O 121.345 0.414 . . . . 0.0 113.59 -176.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.3 m -153.81 92.65 1.58 Allowed 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.8 ptp -163.06 179.71 7.32 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.669 ' HA ' ' HD3' ' A' ' 71' ' ' LYS . 50.3 m -108.61 114.7 28.72 Favored 'General case' 0 N--CA 1.422 -1.845 0 C-N-CA 119.728 -0.789 . . . . 0.0 110.301 176.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.0 p -132.95 135.72 45.69 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.85 -177.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG23 ' HE1' ' A' ' 24' ' ' PHE . 40.8 t -110.29 126.61 67.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -82.4 111.34 18.36 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.635 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.2 p90 -127.36 139.91 52.54 Favored 'General case' 0 C--N 1.28 -2.44 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 pttp -123.1 139.28 54.24 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.001 -1.48 . . . . 0.0 107.876 174.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -78.7 171.23 15.45 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -57.77 -37.54 73.85 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 123.28 0.632 . . . . 0.0 111.867 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.7 m -102.22 9.78 39.79 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-O 121.067 0.46 . . . . 0.0 111.918 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -92.71 135.19 34.32 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.2 mt -96.79 -24.12 16.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.428 0.632 . . . . 0.0 109.796 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -107.13 165.18 11.55 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -92.63 138.59 31.37 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.289 0.566 . . . . 0.0 110.219 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 173.24 7.79 Favored 'General case' 0 C--N 1.281 -2.37 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 175.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.51 128.95 30.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.2 p -111.86 138.89 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.222 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 176.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -116.7 143.84 45.15 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.1 p90 -153.7 176.81 11.68 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -125.81 130.56 51.65 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.403 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.34 -114.63 1.19 Allowed Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -140.9 -45.75 0.39 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.593 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -141.5 158.45 43.83 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -177.36 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -125.43 129.78 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.289 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -63.86 149.52 46.85 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 122.881 0.472 . . . . 0.0 110.471 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 43.2 tp -57.61 -44.75 85.7 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.544 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 50.4 t -56.64 -45.51 81.53 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.953 177.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.96 -42.31 94.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.416 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -62.67 -47.47 83.53 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.267 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HA ' HD23 ' A' ' 51' ' ' LEU . 52.6 mtmt -67.21 -41.82 85.13 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.275 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.5 mptp? -61.7 -35.18 77.3 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -69.1 -49.15 59.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 0.0 110.546 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.2 mt -69.56 -44.09 79.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.311 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.461 ' HG2' HD22 ' A' ' 44' ' ' LEU . 72.3 mtm -62.94 -37.34 86.66 Favored 'General case' 0 CA--C 1.51 -0.591 0 O-C-N 122.23 -0.294 . . . . 0.0 111.34 -178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.94 -41.58 87.52 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -66.89 -38.07 85.59 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 123.079 0.551 . . . . 0.0 112.119 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.96 11.87 37.83 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.967 0.413 . . . . 0.0 111.158 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? 59.34 38.36 23.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.513 172.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.461 HD22 ' HG2' ' A' ' 39' ' ' MET . 9.2 mp -73.13 152.91 40.98 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -83.85 100.48 10.99 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.36 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.41 -8.3 59.41 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.195 -173.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 6.69 42.59 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.155 0.503 . . . . 0.0 109.993 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.571 ' O ' HG12 ' A' ' 82' ' ' ILE . 13.2 t70 -130.23 -40.84 1.28 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.403 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.78 172.54 9.23 Favored 'General case' 0 N--CA 1.418 -2.059 0 CA-C-O 121.552 0.691 . . . . 0.0 111.241 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -126.3 166.74 16.57 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 177.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.9 tp -111.32 118.29 35.48 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.503 ' HB2' HG12 ' A' ' 80' ' ' ILE . 4.4 tp60 -104.51 126.13 51.31 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.422 HD12 HG22 ' A' ' 77' ' ' VAL . 30.3 mm -108.92 135.23 48.44 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.471 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -176.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.7 m -127.17 136.68 52.41 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.531 ' HA ' HG12 ' A' ' 75' ' ' VAL . 12.3 t-20 -64.97 135.09 55.25 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 117.892 0.314 . . . . 0.0 110.3 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.9 -23.26 58.34 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.228 0.537 . . . . 0.0 110.786 -178.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -94.98 -55.81 2.96 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.874 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -92.72 -15.78 26.26 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.891 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.95 21.23 12.54 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.537 0.735 . . . . 0.0 112.458 -174.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -71.96 117.86 14.1 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -81.52 138.91 35.4 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.07 96.98 7.59 Favored 'General case' 0 C--N 1.274 -2.712 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.2 p -94.59 -20.02 19.98 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.742 -175.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -99.64 129.46 45.78 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.574 -174.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -71.22 -7.59 47.86 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.709 0.686 . . . . 0.0 112.191 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -93.07 2.15 56.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.27 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.31 147.64 49.41 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 175.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.593 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -117.54 138.35 51.96 Favored 'General case' 0 C--N 1.28 -2.428 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.685 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -113.96 114.33 46.47 Favored Pre-proline 0 C--N 1.307 -1.279 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.858 175.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.518 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.3 Cg_endo -77.75 161.28 30.68 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.097 2.532 . . . . 0.0 112.806 175.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.669 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 19.9 pttm -66.92 -8.86 32.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.789 0.804 . . . . 0.0 111.219 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.61 -3.22 58.98 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.497 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 41.2 m -114.72 125.48 53.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 120.903 0.382 . . . . 0.0 111.404 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.0 m -90.26 123.58 34.16 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 23.6 m -123.54 155.12 29.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.431 0.634 . . . . 0.0 112.598 -175.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.26 132.23 48.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.495 ' CG1' HD11 ' A' ' 51' ' ' LEU . 70.5 t -105.93 125.46 61.43 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.577 -176.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -131.42 145.24 51.71 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 ttp85 -99.96 126.29 46.1 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 122.051 -0.406 . . . . 0.0 109.987 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -123.66 155.61 66.0 Favored Pre-proline 0 C--N 1.314 -0.976 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -178.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.28 131.33 15.06 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.316 2.01 . . . . 0.0 111.94 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 48' ' ' ASP . 12.4 pt -62.19 -41.97 93.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.511 0.196 . . . . 0.0 111.323 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 178.67 29.41 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.255 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -99.84 -64.62 0.82 Allowed Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 44.8 t -77.22 98.13 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.5 pttp . . . . . 0 C--N 1.299 -1.629 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -176.081 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.789 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.63 161.88 39.54 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 122.352 2.035 . . . . 0.0 111.538 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.3 mt -78.43 69.06 4.56 Favored 'General case' 0 C--O 1.249 1.032 0 CA-C-O 121.693 0.758 . . . . 0.0 111.056 -177.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.78 179.55 17.79 Favored Glycine 0 N--CA 1.425 -2.043 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.954 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t 66.09 15.33 10.04 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 124.622 1.169 . . . . 0.0 112.126 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 75.3 mtp -98.99 174.35 6.39 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.631 -177.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.5 m -86.78 111.59 20.87 Favored 'General case' 0 N--CA 1.409 -2.482 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 18.3 p -124.07 135.42 53.55 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.437 -175.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' HE1' ' A' ' 24' ' ' PHE . 54.0 t -107.93 124.77 64.34 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.42 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 80.2 m-70 -78.04 110.59 13.12 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.518 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 31.0 p90 -128.47 141.37 51.41 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -177.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HE3' HD12 ' A' ' 76' ' ' ILE . 18.6 pttp -117.11 130.94 56.97 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.341 -1.344 . . . . 0.0 107.894 172.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CZ ' HD21 ' A' ' 44' ' ' LEU . 1.9 t80 -85.03 163.44 18.85 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.526 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 11.5 m -56.9 -24.99 56.09 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 123.398 0.679 . . . . 0.0 111.515 175.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.5 m -94.9 -8.58 36.72 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.537 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -112.22 124.46 52.5 Favored 'General case' 0 CA--C 1.506 -0.728 0 O-C-N 121.869 -0.519 . . . . 0.0 110.348 -176.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mp -88.92 -4.87 58.33 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 121.509 0.671 . . . . 0.0 110.43 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -122.22 167.43 13.22 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -91.02 143.7 26.43 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.591 0.71 . . . . 0.0 112.321 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.6 t70 -111.83 177.88 4.5 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -140.21 117.45 11.29 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 118.21 0.459 . . . . 0.0 110.951 -174.435 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -95.6 142.07 14.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.8 p -116.29 133.26 56.21 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -174.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.532 ' HE1' HG23 ' A' ' 9' ' ' VAL . 28.2 p90 -143.12 177.03 8.67 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.602 1.161 . . . . 0.0 107.927 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -120.62 128.35 52.94 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 138.01 -114.03 1.04 Allowed Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.509 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -145.02 -42.45 0.23 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.527 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.08 153.36 42.1 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.4 tt -121.53 132.42 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.852 -178.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.44 ' HB2' ' OD1' ' A' ' 33' ' ' ASP . 37.5 m -64.75 146.52 54.68 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.03 176.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 50.6 tp -57.58 -43.34 84.51 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 124.528 1.131 . . . . 0.0 113.257 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.604 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 37.4 t -56.88 -45.83 82.26 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB2' ' A' ' 30' ' ' SER . 9.0 m-20 -63.38 -47.46 81.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.663 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.56 -47.47 84.13 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.521 1.128 . . . . 0.0 110.708 -176.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.7 mtmt -69.35 -43.48 73.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.952 -178.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.604 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.9 mptp? -61.85 -39.38 91.65 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 90.8 mt-30 -64.99 -50.57 65.81 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.7 mt -63.91 -47.54 90.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.884 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.2 mtm -64.95 -33.61 76.45 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.268 -178.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.66 -43.23 36.88 Favored Glycine 0 C--N 1.312 -0.797 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.268 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -59.52 -42.46 92.29 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 125.093 1.357 . . . . 0.0 111.838 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.429 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 33.6 mt-10 -104.05 8.92 36.63 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.043 -175.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.72 64.23 1.35 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.277 175.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.445 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 10.4 mp -99.73 -176.36 3.24 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.761 -1.109 . . . . 0.0 109.896 177.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 18.5 ptpt -107.47 100.62 10.03 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.88 0.848 . . . . 0.0 110.423 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.56 -18.33 38.7 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.719 -176.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.63 9.21 35.73 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.908 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.581 ' O ' HG12 ' A' ' 82' ' ' ILE . 23.8 t70 -133.36 -47.2 0.83 Allowed 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.762 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.9 m -112.63 176.95 4.8 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.892 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' HB2' HG22 ' A' ' 82' ' ' ILE . 37.2 t70 -124.09 163.08 22.21 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.3 tp -118.5 108.96 15.64 Favored 'General case' 0 N--CA 1.397 -3.104 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.662 ' HB2' HG12 ' A' ' 80' ' ' ILE . 6.3 tp-100 -91.39 120.81 32.57 Favored 'General case' 0 C--N 1.284 -2.255 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.454 HD11 ' HG ' ' A' ' 51' ' ' LEU . 35.2 mm -110.8 127.87 67.58 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.038 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -174.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 m -122.32 140.02 53.14 Favored 'General case' 0 C--N 1.268 -2.946 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.5 t-20 -65.37 131.83 47.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.87 -30.77 70.22 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.284 0.564 . . . . 0.0 110.746 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -91.48 -58.28 2.49 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.161 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.7 p -85.66 -14.94 43.99 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.038 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm 65.25 20.54 11.92 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.045 0.938 . . . . 0.0 111.685 -177.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.82 119.75 14.52 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.833 -1.076 . . . . 0.0 108.957 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -85.39 138.25 32.4 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-O 121.309 0.576 . . . . 0.0 109.92 177.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -100.61 90.42 4.26 Favored 'General case' 0 C--N 1.278 -2.504 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -82.48 -39.61 22.24 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.073 -175.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.693 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 6.8 m-20 -85.53 138.73 32.0 Favored 'General case' 0 CA--C 1.482 -1.638 0 CA-C-N 116.717 -0.219 . . . . 0.0 110.873 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 6.7 m-20 -66.57 -12.37 57.5 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.267 0.556 . . . . 0.0 111.239 -177.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.693 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 8.7 p30 -92.87 1.01 57.51 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.43 -177.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.86 151.64 46.32 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.527 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -118.71 138.02 52.93 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-N 118.137 0.426 . . . . 0.0 111.384 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.92 115.93 43.11 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.927 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' ' 28' ' ' HIS . 48.6 Cg_endo -75.67 153.61 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.867 2.378 . . . . 0.0 113.472 175.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HA ' HG22 ' A' ' 9' ' ' VAL . 18.0 pttp -63.67 -18.22 63.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.561 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -85.53 -4.93 59.31 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.655 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 43.5 m -116.88 139.29 50.8 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 120.906 0.384 . . . . 0.0 111.188 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.5 t -96.53 135.67 38.1 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.6 m -128.82 157.0 41.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 CA-C-O 121.251 0.548 . . . . 0.0 111.693 -177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 ' HE3' ' A' ' 12' ' ' LYS . 31.3 mm -102.04 132.69 47.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 11' ' ' TYR . 54.4 t -110.33 107.23 22.38 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.144 0 CA-C-O 121.442 0.639 . . . . 0.0 110.145 -175.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.526 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 12.0 tpt180 -110.34 123.7 50.33 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.199 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -81.66 122.62 27.86 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 176.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.662 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -125.81 156.59 71.04 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 120.477 0.179 . . . . 0.0 110.779 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.86 135.94 24.35 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 122.378 2.052 . . . . 0.0 111.11 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 48' ' ' ASP . 12.5 pt -62.13 -27.94 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.48 -69.79 0.3 Allowed Glycine 0 N--CA 1.423 -2.174 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -160.7 -92.51 0.09 OUTLIER Glycine 0 N--CA 1.421 -2.32 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 46.5 t -118.1 108.66 24.97 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 122.817 -0.225 . . . . 0.0 110.567 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? . . . . . 0 C--N 1.308 -1.227 0 C-N-CA 123.653 0.781 . . . . 0.0 109.744 175.954 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.493 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -76.54 47.84 2.22 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 123.966 3.11 . . . . 0.0 111.007 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 35.6 mt -98.86 80.75 2.54 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -176.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.94 -61.66 4.74 Favored Glycine 0 N--CA 1.46 0.284 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 -174.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.5 t -165.87 -62.03 0.03 OUTLIER 'General case' 0 N--CA 1.422 -1.847 0 N-CA-C 104.67 -2.344 . . . . 0.0 104.67 173.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp -148.75 136.85 20.92 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 112.957 -1.929 . . . . 0.0 106.015 175.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.605 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 68.1 m -76.73 120.83 22.44 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.9 p -137.93 140.45 40.3 Favored 'General case' 0 N--CA 1.419 -2.0 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.694 -176.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.416 HG23 ' CE1' ' A' ' 24' ' ' PHE . 77.3 t -106.78 124.69 62.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -79.78 114.61 18.84 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 175.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.0 p90 -130.36 141.16 50.58 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -130.56 136.83 49.3 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.57 173.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -86.08 165.67 16.45 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -175.754 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -58.51 -31.61 68.06 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.845 0.831 . . . . 0.0 108.957 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 m -84.32 -13.65 51.83 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 114.9 -1.045 . . . . 0.0 112.049 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' HD2' ' OE1' ' A' ' 42' ' ' GLU . 54.6 mtpt -116.08 126.46 53.78 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 121.885 -0.509 . . . . 0.0 111.252 -173.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.45 -41.01 48.93 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.086 -0.507 . . . . 0.0 112.063 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -104.86 159.56 15.7 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.031 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -77.29 136.96 38.53 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 121.341 0.591 . . . . 0.0 111.982 -177.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.407 ' HB3' ' CE1' ' A' ' 11' ' ' TYR . 6.1 t70 -100.24 172.83 6.92 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.1 p -138.29 122.53 18.14 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -94.37 113.63 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 7' ' ' SER . 6.1 p -88.14 111.18 21.31 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.301 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 7' ' ' SER . 20.9 p90 -128.17 154.8 45.39 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -96.23 101.58 13.25 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.681 0.753 . . . . 0.0 109.675 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 157.49 -174.32 34.94 Favored Glycine 0 C--N 1.287 -2.162 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.64 -42.53 7.21 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.19 150.74 47.05 Favored 'General case' 0 CA--C 1.484 -1.596 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.75 179.788 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -120.65 129.39 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.4 0 CA-C-N 115.025 -0.988 . . . . 0.0 111.299 -177.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.8 m -56.83 141.62 43.91 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.609 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 64' ' ' ASP . 57.7 tp -56.12 -41.87 75.97 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -176.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.561 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 43.4 t -58.34 -45.93 87.22 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.512 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 2.9 m-20 -66.49 -44.52 82.38 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.534 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -59.12 -46.35 88.57 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 124.302 1.041 . . . . 0.0 110.016 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.3 mtmt -64.18 -42.27 96.75 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.655 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.47 -38.63 87.94 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 12.6 mm100 -62.11 -47.97 82.26 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.317 0.579 . . . . 0.0 109.56 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.8 mt -68.72 -42.78 83.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.325 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 62.3 mtt -61.39 -40.82 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.22 0.208 . . . . 0.0 111.065 -178.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.25 -35.78 60.24 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.544 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.48 ' HD2' ' OH ' ' A' ' 11' ' ' TYR . 31.5 ttm180 -73.12 -44.55 60.07 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.833 0.349 . . . . 0.0 111.864 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.488 ' OE1' ' HD2' ' A' ' 16' ' ' LYS . 58.6 mm-40 -91.56 9.05 33.71 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.601 -176.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . 0.34 0.0 OUTLIER 45.55 66.52 0.9 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -177.004 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -93.81 145.27 24.72 Favored 'General case' 0 CA--C 1.491 -1.306 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.596 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 8.0 ptpp? -88.87 101.56 14.17 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.186 173.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.26 -13.79 59.87 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.019 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.21 8.56 23.45 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.62 0.724 . . . . 0.0 109.985 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.484 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 15.0 t70 -130.57 -45.19 1.08 Allowed 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.563 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.564 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 13.3 p -132.72 167.86 19.37 Favored 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.236 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -123.01 170.99 9.59 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 13.9 tp -118.25 127.17 53.48 Favored 'General case' 0 C--N 1.265 -3.103 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.656 HE21 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -116.31 121.1 40.99 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.154 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.408 HD11 ' HG ' ' A' ' 51' ' ' LEU . 34.5 mm -106.73 135.57 44.7 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.7 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -173.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.8 m -122.72 148.02 45.8 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 75' ' ' VAL . 15.4 t-20 -75.16 140.79 43.59 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.27 37.37 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.969 0.414 . . . . 0.0 111.278 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.628 HE21 ' HA ' ' A' ' 57' ' ' GLN . 0.0 OUTLIER -95.65 -47.3 6.27 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.855 -176.092 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.4 p -90.79 -21.45 21.51 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.164 0.507 . . . . 0.0 109.778 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 30.9 mmmt 66.74 26.7 9.46 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.475 1.11 . . . . 0.0 109.914 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -91.86 136.18 33.35 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -79.86 147.56 31.69 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.801 0.81 . . . . 0.0 111.382 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -103.9 95.88 6.31 Favored 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.6 p -80.44 -47.38 14.44 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 114.942 -1.026 . . . . 0.0 113.541 -172.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.431 ' O ' HD23 ' A' ' 31' ' ' LEU . 3.1 t70 -94.65 145.94 24.49 Favored 'General case' 0 CA--C 1.487 -1.455 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.397 -175.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.444 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 8.8 p-10 -69.72 -4.35 19.35 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -88.96 -7.11 56.64 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.971 175.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.49 150.41 48.9 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.78 138.13 52.89 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.598 -0.689 . . . . 0.0 111.609 -174.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -115.3 115.13 42.75 Favored Pre-proline 0 C--N 1.319 -0.732 0 C-N-CA 120.059 -0.657 . . . . 0.0 110.415 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 94.9 Cg_endo -80.48 153.89 20.93 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 C-N-CA 123.154 2.569 . . . . 0.0 113.19 176.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.572 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.4 pttt -59.24 -25.01 63.67 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.68 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -76.57 -5.56 48.21 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -116.13 133.88 55.54 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.408 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.8 m -91.48 137.0 32.71 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 15.4 m -128.0 154.14 38.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 CA-C-O 121.481 0.658 . . . . 0.0 111.87 -177.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.6 mm -102.92 133.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.438 ' CG1' HD11 ' A' ' 51' ' ' LEU . 48.2 t -106.27 109.96 29.78 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-O 121.275 0.56 . . . . 0.0 110.326 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -108.57 132.95 53.35 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.564 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 34.7 ttp85 -95.68 129.77 42.78 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -126.75 156.43 73.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.54 144.44 35.95 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.158 1.905 . . . . 0.0 111.978 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 48' ' ' ASP . 13.2 pt -82.42 -29.25 9.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-O 121.419 0.628 . . . . 0.0 109.44 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 131.76 -61.59 0.66 Allowed Glycine 0 N--CA 1.417 -2.588 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 -175.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.11 -97.6 0.59 Allowed Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.637 177.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 4.9 p -85.88 101.59 10.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.909 0.862 . . . . 0.0 110.024 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp . . . . . 0 C--N 1.302 -1.468 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.332 179.743 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.689 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.67 117.18 4.4 Favored 'Trans proline' 0 C--O 1.241 0.661 0 C-N-CA 122.716 2.277 . . . . 0.0 111.18 177.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -86.83 168.63 13.29 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.59 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.13 0.65 20.82 Favored Glycine 0 C--N 1.292 -1.877 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -175.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 m -95.42 0.88 53.88 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 121.115 0.483 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 70.8 mtp -82.57 111.2 18.35 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.562 ' O ' ' HA ' ' A' ' 23' ' ' THR . 30.4 m -75.67 119.59 19.9 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.216 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.4 p -139.73 135.6 33.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.517 -177.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 21' ' ' THR . 78.9 t -106.9 125.12 62.94 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -76.91 108.94 10.31 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 44.5 p90 -127.22 135.63 50.91 Favored 'General case' 0 C--N 1.28 -2.418 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 pttp -115.8 136.08 53.4 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.05 160.84 16.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.448 ' OG ' ' HA ' ' A' ' 78' ' ' ARG . 16.1 m -58.32 -30.32 66.6 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.53 0.681 . . . . 0.0 110.058 174.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.1 m -86.04 1.61 49.64 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.607 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 138.43 54.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.015 0.912 . . . . 0.0 111.878 177.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -85.96 -27.1 25.12 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -110.2 172.05 7.09 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.611 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -92.11 139.59 30.48 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.224 0.535 . . . . 0.0 112.038 -176.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.13 175.37 5.5 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 173.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.9 p -137.42 131.3 31.78 Favored 'General case' 0 CA--C 1.48 -1.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 7.9 p -109.63 125.32 66.79 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 7' ' ' SER . 4.2 p -90.95 140.99 29.31 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.691 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.504 ' O ' ' HB2' ' A' ' 7' ' ' SER . 30.3 p90 -150.57 174.14 13.31 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 -107.02 140.81 39.23 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.54 -175.02 18.55 Favored Glycine 0 C--N 1.298 -1.565 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 tt -90.06 -40.68 12.14 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.548 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -133.45 155.26 49.86 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.969 -1.014 . . . . 0.0 112.15 -178.273 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.3 tt -121.62 126.6 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.522 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.431 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 13.2 m -60.31 146.88 42.43 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.505 177.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 62' ' ' TYR . 47.5 tp -58.91 -38.12 78.18 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 123.751 0.821 . . . . 0.0 111.399 -177.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.696 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.8 t -55.81 -46.9 77.94 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 175.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 22.2 m-20 -68.61 -41.91 78.87 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.352 -176.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.16 -46.67 70.12 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.035 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 39' ' ' MET . 53.6 mtmt -64.41 -42.86 95.82 Favored 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 121.307 -0.157 . . . . 0.0 111.365 -178.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.44 -36.82 81.45 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.418 0.449 . . . . 0.0 111.037 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 11.8 mm-40 -71.18 -44.37 65.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.334 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.5 mt -66.87 -40.42 85.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.508 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 59.9 mtt -60.36 -40.01 89.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.523 0.201 . . . . 0.0 110.511 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.8 -39.55 54.86 Favored Glycine 0 N--CA 1.438 -1.231 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.941 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -68.76 -49.55 57.78 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -82.37 -14.15 55.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.018 -173.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.7 mmtm 75.37 65.63 0.07 Allowed 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 125.85 1.66 . . . . 0.0 110.528 -178.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.75 152.64 19.46 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.696 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -104.82 102.13 11.7 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.907 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.37 -7.72 51.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.442 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -9.14 43.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.082 0.467 . . . . 0.0 110.545 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.415 ' O ' HG12 ' A' ' 82' ' ' ILE . 12.5 t70 -112.1 -42.53 3.73 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.105 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.8 m -129.86 171.67 12.48 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.03 -176.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.432 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 7.5 t70 -125.45 170.56 11.28 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.446 ' HG ' HD11 ' A' ' 53' ' ' ILE . 18.0 tp -120.9 115.78 23.89 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -173.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.514 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.6 tt0 -114.46 112.89 23.72 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.333 0.587 . . . . 0.0 110.277 -175.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.446 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.8 mp -99.01 135.27 34.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.793 -175.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -124.39 134.92 52.98 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 123.091 0.556 . . . . 0.0 109.513 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.516 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.2 t-20 -61.41 135.34 57.65 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.422 0.289 . . . . 0.0 110.277 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.41 -25.81 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.975 0.417 . . . . 0.0 111.442 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -93.34 -52.38 4.55 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.917 -177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.1 p -95.11 -15.84 23.07 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 62.47 26.61 15.84 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.799 0.809 . . . . 0.0 112.13 -174.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -73.17 116.66 13.96 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.29 126.65 34.97 Favored 'General case' 0 N--CA 1.42 -1.968 0 CA-C-O 121.397 0.618 . . . . 0.0 110.592 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.427 ' HB3' HD22 ' A' ' 31' ' ' LEU . 61.5 m-85 -99.3 104.18 16.06 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-N 114.698 -1.137 . . . . 0.0 108.252 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 57.2 p -113.52 -2.37 13.89 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.745 0.783 . . . . 0.0 110.34 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -106.08 131.93 52.77 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.642 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.3 m-20 -65.58 -12.6 54.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-O 121.311 0.576 . . . . 0.0 111.404 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -91.6 2.13 56.67 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.789 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.61 147.79 47.23 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 173.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.548 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.0 pp -118.99 138.48 52.79 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.265 0.484 . . . . 0.0 110.979 -176.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.17 113.89 35.24 Favored Pre-proline 0 C--N 1.314 -0.965 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.218 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.473 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 69.2 Cg_endo -76.89 152.74 32.46 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.086 2.524 . . . . 0.0 113.379 176.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 43.9 pttt -59.29 -23.74 62.68 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -78.76 -17.18 56.21 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.792 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.9 m -100.03 139.87 35.07 Favored 'General case' 0 C--N 1.308 -1.201 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.358 -175.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -99.38 136.58 39.11 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.2 m -130.99 155.84 42.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 CA-C-O 120.952 0.406 . . . . 0.0 110.66 -177.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.18 130.82 55.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 53' ' ' ILE . 27.0 t -105.78 113.23 42.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.318 -175.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HA ' ' OG ' ' A' ' 14' ' ' SER . 37.6 ttm180 -106.31 143.6 34.2 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.957 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -105.28 117.07 33.07 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.514 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -114.5 154.23 46.58 Favored Pre-proline 0 C--N 1.301 -1.535 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.406 -175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.35 143.75 31.85 Favored 'Trans proline' 0 C--N 1.325 -0.692 0 C-N-CA 122.621 2.214 . . . . 0.0 111.367 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.432 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 14.5 pt -84.47 -16.27 10.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.37 0.605 . . . . 0.0 110.063 177.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.5 -73.46 0.28 Allowed Glycine 0 N--CA 1.419 -2.472 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 178.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -135.0 151.68 20.52 Favored Glycine 0 N--CA 1.402 -3.627 0 N-CA-C 107.902 -2.079 . . . . 0.0 107.902 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.48 125.85 18.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 124.641 0.848 . . . . 0.0 112.011 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 pttm . . . . . 0 C--N 1.301 -1.512 0 CA-C-N 114.629 -1.168 . . . . 0.0 109.115 179.665 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.676 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.28 122.23 9.47 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 122.471 2.114 . . . . 0.0 111.906 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.6 mt -79.69 92.11 5.35 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.175 0.988 . . . . 0.0 110.677 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.5 165.97 25.14 Favored Glycine 0 N--CA 1.414 -2.828 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 47.9 t 70.79 16.38 6.7 Favored 'General case' 0 C--O 1.247 0.941 0 C-N-CA 123.852 0.861 . . . . 0.0 111.741 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 47.8 mtm 60.2 -164.13 0.23 Allowed 'General case' 0 C--O 1.248 1.021 0 CA-C-O 121.816 0.817 . . . . 0.0 112.352 176.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 73.4 m -132.27 117.76 18.61 Favored 'General case' 0 N--CA 1.406 -2.637 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 34.4 m -133.1 134.86 44.83 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.069 -172.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.501 ' O ' ' HA ' ' A' ' 21' ' ' THR . 92.2 t -106.54 134.46 48.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 175.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.435 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 41.9 m-70 -84.22 123.06 29.71 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 123.775 0.672 . . . . 0.0 109.324 177.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.606 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 53.3 p90 -136.64 142.27 43.23 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.072 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.44 ' HE3' HD12 ' A' ' 76' ' ' ILE . 21.7 pttp -123.64 116.23 22.76 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 119.801 -0.759 . . . . 0.0 110.232 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.652 ' HA ' HG13 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -68.77 165.61 19.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.435 -1.257 . . . . 0.0 111.275 178.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.4 m -56.61 -37.1 70.2 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.967 176.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.3 t -106.84 19.78 19.98 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.056 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -99.64 138.4 36.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 mt -90.69 -31.72 16.48 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.647 0.737 . . . . 0.0 109.708 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -129.94 177.14 7.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -83.34 146.83 28.28 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.062 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.4 t70 -115.2 178.66 4.21 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.2 p -136.57 121.74 19.11 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 118.734 0.697 . . . . 0.0 110.677 -172.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.1 p -95.87 134.68 32.51 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.408 HG22 ' SG ' ' A' ' 8' ' ' CYS . 5.3 p -102.66 126.51 49.78 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.146 0.498 . . . . 0.0 111.494 -175.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' A' ' 7' ' ' SER . 29.3 p90 -141.29 172.27 12.91 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -106.83 137.5 44.75 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.0 -167.05 12.36 Favored Glycine 0 N--CA 1.429 -1.82 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.401 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.2 tm? -98.03 -31.63 12.05 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.631 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -144.16 147.67 33.99 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.1 tt -112.16 123.95 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.297 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.9 m -63.97 143.32 57.95 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.953 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 34' ' ' LEU . 46.8 tp -54.84 -41.05 70.27 Favored 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 124.684 1.194 . . . . 0.0 112.533 -175.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.639 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 32.2 t -53.18 -45.9 68.74 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 123.219 0.325 . . . . 0.0 110.339 176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.7 -39.8 61.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.523 0.678 . . . . 0.0 110.02 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 3.0 tm? -58.77 -47.21 85.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.287 -177.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' O ' ' HG3' ' A' ' 39' ' ' MET . 51.3 mtmt -70.68 -44.76 66.36 Favored 'General case' 0 C--O 1.203 -1.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.218 -178.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.0 mptp? -61.29 -37.71 84.16 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -175.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -64.64 -45.19 87.84 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.459 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.5 mt -73.95 -41.48 53.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.029 -176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 88.8 mtp -62.25 -37.64 86.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.708 0.289 . . . . 0.0 110.576 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.46 -42.4 41.31 Favored Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.781 176.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -64.73 -47.65 77.48 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -89.09 11.16 19.24 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.488 -175.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? 55.06 62.09 2.66 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 123.94 0.896 . . . . 0.0 111.169 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -91.61 145.88 24.24 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.567 177.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.621 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -95.13 101.77 13.54 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.58 -8.55 55.78 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.964 -175.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -90.18 -1.73 57.97 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.932 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.619 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 16.6 t70 -129.08 -37.12 1.71 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.453 0.644 . . . . 0.0 110.474 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.8 m -128.78 166.12 19.62 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-O 121.814 0.816 . . . . 0.0 112.424 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.495 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 21.2 t0 -125.47 169.32 12.52 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 126.02 1.728 . . . . 0.0 106.687 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.5 tp -117.42 111.25 19.06 Favored 'General case' 0 N--CA 1.404 -2.749 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.573 HE21 HG21 ' A' ' 80' ' ' ILE . 9.4 tt0 -109.34 111.23 22.67 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.593 0.711 . . . . 0.0 109.853 -178.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' HG23 ' A' ' 77' ' ' VAL . 18.7 mm -92.95 136.18 25.68 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -123.37 143.19 50.27 Favored 'General case' 0 C--N 1.275 -2.654 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.433 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.0 t-20 -68.58 136.22 52.72 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 122.039 -0.413 . . . . 0.0 110.559 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -28.18 64.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -91.21 -58.18 2.54 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 121.186 0.517 . . . . 0.0 111.192 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 p -91.68 -17.44 25.47 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.195 -169.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.94 23.41 12.59 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.621 0.724 . . . . 0.0 112.549 -173.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.03 115.95 7.31 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -87.4 128.15 35.21 Favored 'General case' 0 N--CA 1.413 -2.293 0 CA-C-O 121.874 0.845 . . . . 0.0 110.174 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.2 93.53 8.73 Favored 'General case' 0 C--N 1.267 -2.995 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.062 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.8 p -98.36 -26.83 14.35 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.521 -1.218 . . . . 0.0 111.032 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -90.11 135.17 33.82 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 5.3 m-20 -68.81 -13.15 62.22 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.895 0.379 . . . . 0.0 111.801 -176.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -83.59 -9.19 59.08 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.155 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.12 136.25 57.67 Favored 'General case' 0 C--O 1.2 -1.513 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.631 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -117.82 137.65 52.61 Favored 'General case' 0 C--N 1.281 -2.391 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.221 -176.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mp -117.04 118.79 35.74 Favored Pre-proline 0 C--N 1.297 -1.693 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.729 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.3 Cg_endo -78.68 157.94 28.23 Favored 'Trans proline' 0 C--N 1.324 -0.718 0 C-N-CA 123.218 2.612 . . . . 0.0 113.404 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 49.6 pttt -70.19 -5.48 27.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.9 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -87.83 -4.27 58.88 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.759 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.3 m -122.43 157.94 30.82 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-O 120.973 0.416 . . . . 0.0 111.247 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m -118.86 137.76 53.21 Favored 'General case' 0 N--CA 1.422 -1.837 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 12.5 m -130.48 163.85 35.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 CA-C-O 121.48 0.657 . . . . 0.0 111.697 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 ' HE3' ' A' ' 12' ' ' LYS . 13.9 mm -109.47 132.28 58.05 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.652 HG13 ' HA ' ' A' ' 13' ' ' PHE . 1.7 p -112.78 106.55 20.99 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 122.173 0.987 . . . . 0.0 111.207 -177.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -103.26 131.79 50.03 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.843 -174.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -90.51 117.57 29.3 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.573 HG21 HE21 ' A' ' 52' ' ' GLN . 2.5 pp -116.6 151.56 47.26 Favored Pre-proline 0 C--N 1.308 -1.219 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -177.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -75.38 138.08 21.7 Favored 'Trans proline' 0 CA--C 1.549 1.248 0 C-N-CA 122.399 2.066 . . . . 0.0 112.362 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.495 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 12.7 pt -76.86 -44.17 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.326 0.584 . . . . 0.0 110.663 177.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -176.68 64.77 0.09 OUTLIER Glycine 0 N--CA 1.429 -1.787 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -155.74 147.83 17.15 Favored Glycine 0 N--CA 1.427 -1.932 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.7 m -87.16 112.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.334 0 CA-C-O 122.019 0.914 . . . . 0.0 111.766 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp . . . . . 0 C--N 1.3 -1.583 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 -178.469 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.421 0 N-CA-C 110.964 -0.855 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -62.12 -50.56 4.7 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.726 2.284 . . . . 0.0 110.857 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.4 tp -95.56 130.99 42.23 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.11 -42.22 98.15 Favored Glycine 0 C--O 1.226 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.558 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.5 m -72.04 -25.26 61.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.414 0.626 . . . . 0.0 110.42 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 87.2 mtp 63.96 173.73 0.18 Allowed 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.881 -175.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 71' ' ' LYS . 67.4 m -98.5 139.81 33.69 Favored 'General case' 0 N--CA 1.406 -2.657 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.239 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.626 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.1 p -144.73 135.14 24.37 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.084 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' A' ' 71' ' ' LYS . 69.0 t -106.19 125.63 61.82 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -81.05 117.31 21.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 124.185 0.928 . . . . 0.0 108.874 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.621 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 39.5 p90 -133.26 140.55 47.55 Favored 'General case' 0 C--N 1.29 -1.995 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -124.26 140.92 52.5 Favored 'General case' 0 C--N 1.283 -2.291 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.62 165.68 18.8 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 m -56.55 -37.36 70.41 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.812 0.815 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.92 -3.87 55.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.573 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -110.52 143.34 41.01 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.9 tp -94.99 -37.73 11.0 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.573 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -99.97 158.02 16.12 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.391 -0.523 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.65 137.14 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 116.07 -0.514 . . . . 0.0 112.039 -176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -95.31 174.7 6.91 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 171.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.7 OUTLIER -138.34 133.91 33.58 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -175.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.626 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.3 m -94.9 114.92 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 171.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.7 p -90.21 114.41 26.39 Favored 'General case' 0 N--CA 1.41 -2.46 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.152 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.434 ' CE1' HG23 ' A' ' 9' ' ' VAL . 5.5 p90 -135.83 165.39 25.73 Favored 'General case' 0 C--N 1.282 -2.327 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -177.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 6.01 32.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -174.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.48 -178.52 45.37 Favored Glycine 0 C--N 1.285 -2.25 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.577 177.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -89.78 -39.84 12.86 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -141.81 153.27 44.4 Favored 'General case' 0 CA--C 1.488 -1.437 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.045 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.0 tt -123.47 129.41 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.242 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.711 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -63.11 145.0 56.41 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.234 178.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.1 tp -54.99 -44.43 74.48 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.502 1.121 . . . . 0.0 112.981 -176.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.547 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.8 t -57.0 -45.58 82.9 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.148 0.499 . . . . 0.0 109.755 178.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 9.4 m-20 -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.146 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.77 95.96 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.04 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' HD23 ' A' ' 51' ' ' LEU . 54.7 mtmt -63.11 -41.55 99.38 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.252 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.1 mptt -61.61 -37.46 84.0 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.593 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.531 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -66.03 -50.23 64.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.083 0.468 . . . . 0.0 109.796 178.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.32 -43.36 91.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.632 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' HD22 ' A' ' 44' ' ' LEU . 71.7 mtm -66.02 -34.99 79.35 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.222 -0.191 . . . . 0.0 111.264 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.2 -39.98 51.12 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.496 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.416 HH22 ' HA ' ' A' ' 22' ' ' VAL . 23.7 ttm180 -67.47 -48.03 68.36 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 123.375 0.67 . . . . 0.0 112.151 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -91.49 2.11 56.66 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.316 -174.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.39 65.45 1.17 Allowed 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 124.444 1.098 . . . . 0.0 111.28 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 ' HG2' ' A' ' 39' ' ' MET . 10.8 mp -95.09 173.55 7.52 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.21 177.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HG3' ' SG ' ' A' ' 49' ' ' CYS . 16.8 ptpt -105.95 101.33 10.83 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.334 178.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.92 -13.29 59.89 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.384 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.58 4.68 45.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.997 0.427 . . . . 0.0 111.211 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -124.72 -40.53 2.19 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.391 0.615 . . . . 0.0 109.464 -178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.462 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 24.4 p -134.03 164.35 27.52 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.963 -178.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 82' ' ' ILE . 4.8 t0 -116.12 170.36 8.56 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.508 HD23 ' HA ' ' A' ' 35' ' ' LYS . 18.8 tp -115.43 123.71 49.3 Favored 'General case' 0 C--N 1.267 -3.019 0 CA-C-O 121.456 0.646 . . . . 0.0 109.283 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.552 ' HB2' HG12 ' A' ' 80' ' ' ILE . 5.1 tp-100 -103.4 123.94 47.78 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -177.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.412 HD11 ' HG ' ' A' ' 51' ' ' LEU . 2.1 mp -116.79 127.83 74.32 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.936 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.3 m -115.73 146.89 41.5 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.616 ' HA ' HG12 ' A' ' 75' ' ' VAL . 13.8 t-20 -77.0 138.14 39.42 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.16 -21.42 46.48 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.683 0.754 . . . . 0.0 110.987 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -98.53 -56.23 2.52 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.927 -175.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.9 p -85.93 -19.65 30.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.553 0.692 . . . . 0.0 109.672 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.1 mmtp 63.45 21.07 12.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.914 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -77.89 129.51 35.46 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -93.62 127.82 39.49 Favored 'General case' 0 N--CA 1.416 -2.13 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -94.65 96.0 9.13 Favored 'General case' 0 C--N 1.269 -2.895 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -92.54 -21.14 20.28 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.025 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.622 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 12.8 m-20 -97.92 133.35 42.52 Favored 'General case' 0 CA--C 1.492 -1.275 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.475 ' HA ' HD23 ' A' ' 31' ' ' LEU . 3.1 p30 -73.39 -4.07 31.22 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -175.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.622 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 6.9 p30 -85.35 -10.05 56.83 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.043 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.0 146.11 48.28 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.494 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.45 137.42 52.52 Favored 'General case' 0 C--N 1.289 -2.041 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.328 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.65 114.44 39.92 Favored Pre-proline 0 N--CA 1.435 -1.193 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.065 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 72.0 Cg_endo -78.89 156.67 27.16 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.166 2.577 . . . . 0.0 112.389 176.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.484 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.62 -7.48 33.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.925 0.869 . . . . 0.0 111.811 178.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -83.43 -11.88 57.04 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.39 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.9 m -112.58 152.25 29.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 120.888 0.375 . . . . 0.0 111.366 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.9 m -109.9 132.42 54.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 173.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.621 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.8 m -127.39 160.52 36.37 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -175.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.1 mm -112.29 132.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 HG13 ' A' ' 53' ' ' ILE . 25.0 t -109.24 129.71 63.51 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 CA-C-O 121.086 0.47 . . . . 0.0 110.789 -175.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 52' ' ' GLN . 29.4 ttm180 -126.61 152.26 46.88 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 125.225 1.41 . . . . 0.0 107.744 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.406 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 18.3 ttp180 -110.24 127.74 55.14 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.552 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.9 pp -132.59 161.58 62.43 Favored Pre-proline 0 C--O 1.21 -0.995 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.693 -175.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 80' ' ' ILE . 33.2 Cg_endo -66.89 138.16 47.43 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 122.362 2.041 . . . . 0.0 112.12 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.437 HG23 ' C ' ' A' ' 49' ' ' CYS . 4.9 pt -61.3 -36.12 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 155.75 -67.13 0.3 Allowed Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 118.916 -1.611 . . . . 0.0 112.608 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.71 -42.12 7.92 Favored Glycine 0 CA--C 1.484 -1.89 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.45 90.56 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 86' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--N 1.292 -1.923 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.55 -178.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.554 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -79.67 54.6 5.27 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 123.65 2.9 . . . . 0.0 112.636 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -85.9 -5.84 59.17 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.57 30.49 5.29 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.582 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.6 t -149.62 24.03 0.88 Allowed 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 92.8 mmm 58.85 113.13 0.01 OUTLIER 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 125.112 1.365 . . . . 0.0 112.931 -173.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 46.0 m -74.32 120.68 20.22 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.781 -176.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.642 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 6.6 p -147.78 142.41 26.6 Favored 'General case' 0 N--CA 1.422 -1.826 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.608 -175.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.8 t -107.18 136.55 41.87 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 178.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 -83.32 109.54 17.36 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HG13 ' A' ' 22' ' ' VAL . 30.9 p90 -124.81 140.2 53.14 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 19' ' ' TYR . 63.8 pttt -125.68 123.2 38.38 Favored 'General case' 0 C--N 1.293 -1.872 0 C-N-CA 118.443 -1.303 . . . . 0.0 110.956 174.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 77' ' ' VAL . 1.4 t80 -84.34 172.44 11.79 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 114.074 -1.421 . . . . 0.0 108.276 -176.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.3 m -64.13 -27.0 68.78 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.563 0.697 . . . . 0.0 109.232 170.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.7 m -82.57 -20.32 36.77 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.338 178.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.56 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 0.9 OUTLIER -111.65 101.46 9.85 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.76 -33.27 75.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.592 0.71 . . . . 0.0 110.646 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -114.36 169.19 9.22 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.633 175.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.445 ' HA ' ' HB3' ' A' ' 12' ' ' LYS . 98.5 m-85 -70.5 147.64 49.15 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -121.88 177.35 5.33 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 104.615 -2.365 . . . . 0.0 104.615 176.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 2.8 p -135.64 127.19 28.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -95.97 114.95 33.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.574 171.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 7' ' ' SER . 2.2 p -85.47 124.86 32.54 Favored 'General case' 0 N--CA 1.418 -2.045 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 7' ' ' SER . 38.5 p90 -142.28 176.68 8.8 Favored 'General case' 0 N--CA 1.434 -1.266 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -105.35 136.66 44.48 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.687 0.279 . . . . 0.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.95 -147.74 18.5 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.533 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.33 -39.8 4.32 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -138.75 157.86 45.3 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.432 -179.069 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -128.35 129.43 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.092 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.336 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.8 m -61.66 148.08 43.76 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.054 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.45 HD23 ' O ' ' A' ' 64' ' ' ASP . 51.7 tp -57.48 -41.53 80.87 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 124.186 0.994 . . . . 0.0 112.547 -176.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.678 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 48.0 t -55.61 -46.47 77.33 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 4.5 m-20 -69.88 -42.57 73.27 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.28 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.416 ' HG ' HD13 ' A' ' 69' ' ' ILE . 2.5 tm? -59.69 -46.8 87.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 124.03 0.932 . . . . 0.0 110.361 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' HD23 ' A' ' 51' ' ' LEU . 53.9 mtmt -67.19 -38.3 85.15 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.566 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.678 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 1.6 mptm? -61.39 -36.57 80.64 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 14.0 mm100 -64.4 -50.09 69.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 109.491 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.2 mt -73.01 -41.4 59.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.471 -174.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 61.4 mtt -59.94 -44.43 94.37 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 110.455 -0.202 . . . . 0.0 110.455 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.78 -33.7 71.29 Favored Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.727 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -71.92 -46.44 57.61 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -91.5 -1.5 57.51 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 120.858 0.361 . . . . 0.0 111.943 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm 66.93 66.96 0.42 Allowed 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 125.08 1.352 . . . . 0.0 110.363 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.81 170.01 9.61 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' A' ' 48' ' ' ASP . 17.9 ptpt -112.46 101.72 9.87 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.099 175.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -83.15 -6.6 59.54 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.364 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.94 -3.97 53.56 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.389 0.614 . . . . 0.0 110.171 177.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.431 ' C ' HG12 ' A' ' 82' ' ' ILE . 31.8 t70 -128.68 -30.3 2.31 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.58 0.705 . . . . 0.0 111.486 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.6 m -132.06 157.24 44.67 Favored 'General case' 0 N--CA 1.414 -2.229 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.38 -176.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.572 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 37.5 t0 -120.01 162.19 19.66 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 53' ' ' ILE . 21.3 tp -108.92 108.13 18.77 Favored 'General case' 0 C--N 1.257 -3.429 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 -177.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.464 HE21 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -97.53 116.66 30.17 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-O 121.693 0.759 . . . . 0.0 109.249 -174.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.579 HD11 ' HG ' ' A' ' 51' ' ' LEU . 21.2 mm -105.26 130.52 56.36 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.757 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 m -125.02 141.59 52.03 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.59 128.9 38.51 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 122.594 0.357 . . . . 0.0 110.955 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.87 -29.51 65.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.24 0.543 . . . . 0.0 110.341 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -87.78 -58.11 2.69 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.862 -177.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.4 p -90.64 -14.28 32.66 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -171.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 63.17 21.69 12.98 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 123.344 0.658 . . . . 0.0 112.769 -172.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -74.74 121.87 22.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -92.31 119.54 31.99 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.571 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 87.7 m-85 -55.72 -65.29 0.62 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 123.645 0.778 . . . . 0.0 112.416 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.8 p 74.41 -36.8 0.34 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 127.802 2.441 . . . . 0.0 114.631 171.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' HD23 ' A' ' 31' ' ' LEU . 4.6 t70 -95.49 132.88 40.12 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -174.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 9.5 m-20 -65.27 -14.18 60.14 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.24 0.543 . . . . 0.0 111.703 -175.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -91.97 -1.97 56.99 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.48 -178.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 62' ' ' TYR . . . -72.49 145.1 47.76 Favored 'General case' 0 C--O 1.194 -1.836 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.3 pp -117.53 138.32 51.98 Favored 'General case' 0 C--N 1.288 -2.104 0 CA-C-N 118.825 0.739 . . . . 0.0 111.399 -173.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.494 HG13 ' CZ ' ' A' ' 62' ' ' TYR . 3.2 mp -114.06 115.51 45.5 Favored Pre-proline 0 C--N 1.312 -1.042 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.506 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 92.3 Cg_endo -81.11 159.62 20.57 Favored 'Trans proline' 0 C--N 1.324 -0.761 0 C-N-CA 123.116 2.544 . . . . 0.0 113.479 175.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -73.35 4.83 4.18 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.966 176.049 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -87.54 -19.07 28.39 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 35.0 m -109.63 162.31 14.55 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.625 0.726 . . . . 0.0 112.765 -173.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.4 m -121.51 130.56 53.62 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 172.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 20.6 m -129.01 158.79 41.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.4 mm -99.69 129.17 50.68 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.562 ' O ' ' HA ' ' A' ' 13' ' ' PHE . 59.9 t -109.74 111.48 36.33 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 CA-C-O 121.556 0.693 . . . . 0.0 109.46 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.0 ttp-105 -121.23 136.34 54.99 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.824 -174.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -93.08 128.35 38.95 Favored 'General case' 0 C--N 1.292 -1.899 0 O-C-N 121.954 -0.466 . . . . 0.0 110.216 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.481 HD11 ' HB3' ' A' ' 50' ' ' ASP . 2.5 pp -125.72 152.37 72.16 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 144.92 17.09 Favored 'Trans proline' 0 C--N 1.326 -0.649 0 C-N-CA 122.153 1.902 . . . . 0.0 111.117 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.572 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 29.3 pt -95.92 -39.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 C-N-CA 119.306 -0.957 . . . . 0.0 111.434 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.26 50.6 64.87 Favored Glycine 0 N--CA 1.442 -0.932 0 O-C-N 123.764 0.665 . . . . 0.0 111.54 -177.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -95.32 57.3 1.71 Allowed Glycine 0 N--CA 1.421 -2.319 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 40.2 t -78.6 90.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.387 0 CA-C-O 121.628 0.727 . . . . 0.0 109.929 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? . . . . . 0 C--N 1.282 -2.349 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.764 177.048 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.406 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.72 2.84 5.44 Favored 'Trans proline' 0 C--N 1.365 1.401 0 C-N-CA 123.531 2.821 . . . . 0.0 111.7 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -146.71 155.71 42.62 Favored 'General case' 0 N--CA 1.412 -2.325 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -117.48 24.53 9.08 Favored Glycine 0 C--N 1.298 -1.534 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m -79.74 -2.91 45.19 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -175.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.9 mtp -119.24 152.05 37.34 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.522 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 49.5 m -134.65 133.17 39.8 Favored 'General case' 0 C--N 1.274 -2.68 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.411 -174.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 11.3 p -145.01 141.77 29.21 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.007 -178.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.515 HG23 ' CE1' ' A' ' 24' ' ' PHE . 87.2 t -107.02 129.9 59.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -80.61 110.85 16.49 Favored 'General case' 0 CA--C 1.491 -1.293 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 174.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.607 ' OH ' ' HG2' ' A' ' 41' ' ' ARG . 37.6 p90 -131.9 146.37 52.07 Favored 'General case' 0 C--N 1.28 -2.449 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -130.55 141.98 50.47 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.501 ' HZ ' HD21 ' A' ' 44' ' ' LEU . 1.1 t80 -89.81 169.35 11.34 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -177.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.2 m -56.93 -37.01 70.89 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.999 0.428 . . . . 0.0 111.297 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.7 m -90.99 4.02 53.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 25.9 mtpp -117.62 125.93 51.62 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.0 tt -83.26 -42.0 17.7 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.2 157.81 20.53 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -88.44 146.78 25.03 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 120.964 0.411 . . . . 0.0 110.698 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -112.06 174.76 5.73 Favored 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 p -139.37 115.71 10.5 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-O 121.144 0.497 . . . . 0.0 111.238 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.567 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.8 p -95.86 120.85 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.082 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 177.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 7' ' ' SER . 3.0 p -87.95 140.24 29.7 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.515 ' CE1' HG23 ' A' ' 9' ' ' VAL . 33.8 p90 -151.94 170.89 18.75 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -178.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -102.45 138.29 39.57 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.09 -173.91 17.06 Favored Glycine 0 N--CA 1.433 -1.509 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -88.66 -31.32 18.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.563 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -147.69 157.5 43.58 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -175.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 tt -121.73 128.5 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.247 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 16.3 m -63.79 147.09 52.65 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.223 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 64' ' ' ASP . 48.2 tp -57.81 -42.77 84.97 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 124.019 0.927 . . . . 0.0 112.419 -176.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 41.9 t -54.25 -45.17 72.33 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 19.2 m-20 -68.23 -49.69 59.01 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.463 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.2 -45.47 91.0 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.822 -1.081 . . . . 0.0 112.746 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' HD23 ' A' ' 51' ' ' LEU . 51.9 mtmt -63.05 -41.49 99.49 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.785 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.613 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 4.3 mptp? -61.58 -38.48 87.68 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 120.664 0.268 . . . . 0.0 110.373 178.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 15.4 mm100 -68.15 -50.15 56.44 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.69 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.8 mt -70.47 -39.07 75.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.7 mtm -64.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.967 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.36 -35.53 56.29 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.449 175.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG2' ' OH ' ' A' ' 11' ' ' TYR . 25.3 tpt180 -61.06 -51.17 70.31 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.197 0.999 . . . . 0.0 111.9 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.38 -1.12 54.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.86 0.362 . . . . 0.0 111.856 -176.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm 66.22 68.5 0.44 Allowed 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 125.092 1.357 . . . . 0.0 110.48 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 ' HZ ' ' A' ' 13' ' ' PHE . 9.3 mp -95.52 158.22 15.55 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.793 178.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' HD3' ' HB2' ' A' ' 48' ' ' ASP . 8.1 ptpp? -85.1 101.04 12.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 170.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.72 -7.49 59.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -169.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.22 -12.85 17.7 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.705 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.473 ' HB2' ' HD3' ' A' ' 45' ' ' LYS . 4.0 m-20 -105.93 -16.5 14.62 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -175.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -148.03 170.29 18.07 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.461 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 28.4 t70 -120.94 164.9 16.0 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -178.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.475 HD11 ' CG1' ' A' ' 77' ' ' VAL . 19.5 tp -116.27 113.62 23.24 Favored 'General case' 0 N--CA 1.405 -2.724 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.539 ' HB2' HG12 ' A' ' 80' ' ' ILE . 33.8 tt0 -111.13 112.0 23.49 Favored 'General case' 0 C--N 1.281 -2.402 0 CA-C-O 121.781 0.801 . . . . 0.0 109.23 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.434 ' CD1' HG13 ' A' ' 77' ' ' VAL . 29.0 mm -90.53 135.77 25.68 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.48 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.663 -172.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 61' ' ' GLU . 14.9 m -117.88 145.33 44.7 Favored 'General case' 0 C--N 1.284 -2.254 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.4 t-20 -74.73 141.98 44.42 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -84.97 -27.52 26.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.715 0.769 . . . . 0.0 110.62 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -85.03 -48.68 8.99 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.559 -175.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -98.1 -20.27 17.45 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.252 0.548 . . . . 0.0 110.076 -176.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 60.79 36.96 19.05 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.675 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -101.27 132.57 46.72 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 1.1 mp0 -81.69 148.11 29.16 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-O 121.878 0.847 . . . . 0.0 112.36 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -108.14 101.11 10.37 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 173.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.8 p -97.97 -27.26 14.33 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.286 0.565 . . . . 0.0 112.013 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' HD23 ' A' ' 31' ' ' LEU . 29.8 m-20 -91.01 128.46 36.84 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -177.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -66.96 -6.26 16.05 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -95.32 1.77 54.52 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.749 178.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.53 152.72 43.67 Favored 'General case' 0 C--O 1.207 -1.182 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 173.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.563 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.83 138.29 52.82 Favored 'General case' 0 C--N 1.289 -2.031 0 O-C-N 121.77 -0.581 . . . . 0.0 111.473 -178.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.49 117.16 38.55 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.223 175.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.476 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 74.0 Cg_endo -80.21 161.17 23.21 Favored 'Trans proline' 0 C--N 1.328 -0.523 0 C-N-CA 123.522 2.815 . . . . 0.0 114.064 177.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.522 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 47.4 pttt -67.62 -16.37 64.13 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.222 176.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -70.87 -25.64 62.89 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.796 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.8 m -98.32 159.68 14.79 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-O 121.639 0.733 . . . . 0.0 112.17 -173.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.9 m -124.01 127.87 48.54 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 173.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 55' ' ' ASN . 21.9 m -125.38 155.0 34.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 CA-C-O 121.593 0.711 . . . . 0.0 112.8 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.4 mm -104.16 127.84 58.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.475 ' CG1' HD11 ' A' ' 51' ' ' LEU . 60.0 t -99.46 111.58 29.46 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.519 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.359 -175.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -110.55 130.93 55.45 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.889 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -89.75 127.55 35.97 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.539 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.5 pp -121.85 150.11 55.04 Favored Pre-proline 0 C--N 1.305 -1.364 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.085 -178.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.51 137.92 18.97 Favored 'Trans proline' 0 N--CA 1.448 -1.165 0 C-N-CA 122.063 1.842 . . . . 0.0 112.196 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.461 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 36.6 pt -89.7 -21.1 6.86 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 127.58 -56.31 0.73 Allowed Glycine 0 N--CA 1.424 -2.14 0 N-CA-C 108.288 -1.925 . . . . 0.0 108.288 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 142.05 52.3 0.04 OUTLIER Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 41.2 t -98.09 91.12 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.161 0 CA-C-O 121.733 0.777 . . . . 0.0 111.071 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.49 ' OXT' ' HD2' ' A' ' 86' ' ' LYS . 1.6 pptp? . . . . . 0 N--CA 1.408 -2.543 0 CA-C-N 113.822 -1.535 . . . . 0.0 107.293 175.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.306 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -66.35 -24.96 49.56 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.725 2.283 . . . . 0.0 112.647 -178.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -100.83 12.41 37.63 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.99 55.66 1.84 Allowed Glycine 0 N--CA 1.43 -1.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.493 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 m 64.35 15.58 9.57 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.56 1.144 . . . . 0.0 112.998 176.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 41.3 mtm -109.84 157.69 18.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.1 m -98.84 128.53 45.07 Favored 'General case' 0 N--CA 1.414 -2.264 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.5 p -127.29 128.61 46.25 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.075 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 71' ' ' LYS . 41.2 t -106.93 131.05 57.88 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -86.64 112.7 21.86 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 45.1 p90 -126.2 133.23 51.59 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.867 -177.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -118.35 135.74 54.14 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.134 -1.026 . . . . 0.0 108.962 175.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.533 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 1.2 t80 -92.52 165.34 13.07 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -176.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -56.86 -31.95 65.32 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.45 0.643 . . . . 0.0 109.799 175.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.5 m -82.68 -8.73 59.58 Favored 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.959 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD2' ' H ' ' A' ' 13' ' ' PHE . 65.5 mttm -108.66 146.33 33.6 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 121.928 -0.483 . . . . 0.0 110.72 -177.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.4 tp -92.65 -46.19 7.71 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 171.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -97.24 155.87 16.67 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.778 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -75.8 135.96 40.25 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 121.305 0.574 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -94.74 177.85 5.78 Favored 'General case' 0 C--N 1.287 -2.139 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -137.48 128.11 26.85 Favored 'General case' 0 C--N 1.28 -2.44 0 CA-C-N 118.432 0.56 . . . . 0.0 111.462 -174.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.528 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.9 p -113.22 136.28 50.07 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 7' ' ' SER . 7.0 p -112.28 138.76 48.52 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 120.849 0.357 . . . . 0.0 111.517 -178.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.567 ' HE1' HG23 ' A' ' 9' ' ' VAL . 35.1 p90 -151.57 176.3 11.48 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.69 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -103.82 150.11 24.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 175.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.07 161.52 34.19 Favored Glycine 0 C--N 1.303 -1.296 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 tt -71.88 -32.79 67.79 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 118.074 0.937 . . . . 0.0 108.841 -177.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.518 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -138.5 159.8 41.16 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.369 -176.142 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 13.8 tt -128.66 128.15 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.593 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.9 t -56.83 142.27 41.53 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.893 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.2 tp -58.23 -34.77 70.8 Favored 'General case' 0 N--CA 1.419 -1.994 0 C-N-CA 124.738 1.215 . . . . 0.0 110.727 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.698 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 11.7 t -58.36 -46.49 86.2 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -74.42 -41.46 60.84 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.613 -176.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 2.5 tm? -59.0 -47.34 85.54 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.001 1.32 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 54.5 mtmt -67.05 -43.29 83.08 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 120.535 0.207 . . . . 0.0 111.021 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.698 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 12.7 mptt -61.92 -35.19 77.67 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.83 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.03 -49.95 72.62 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 120.881 0.372 . . . . 0.0 110.152 175.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.8 mt -69.17 -44.85 80.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.739 -175.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 73.8 mtm -66.05 -39.89 90.49 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.238 -178.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.24 -37.11 86.22 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.038 -1.077 . . . . 0.0 111.221 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -65.43 -49.03 70.69 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 123.065 0.546 . . . . 0.0 111.836 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 46.5 mt-10 -103.34 19.6 19.36 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.8 mmtt 62.16 34.11 16.44 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.676 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.8 mp -71.96 132.77 44.77 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.068 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG3' ' HB3' ' A' ' 48' ' ' ASP . 16.4 ptpt -71.86 101.4 2.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 122.144 0.973 . . . . 0.0 111.293 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.71 -7.91 57.19 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.896 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.83 -0.4 45.23 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.574 0.702 . . . . 0.0 110.349 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.465 ' HB3' ' HG3' ' A' ' 45' ' ' LYS . 9.3 t70 -113.05 -41.18 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.032 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -133.34 166.7 21.89 Favored 'General case' 0 N--CA 1.415 -2.225 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.459 -174.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.492 ' HB2' HG22 ' A' ' 82' ' ' ILE . 48.7 t0 -116.86 166.66 11.9 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 174.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.546 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 14.2 tp -112.79 125.45 54.36 Favored 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -111.52 109.04 18.77 Favored 'General case' 0 C--N 1.284 -2.277 0 O-C-N 121.777 -0.577 . . . . 0.0 109.709 -177.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.467 HD11 ' HG ' ' A' ' 51' ' ' LEU . 1.9 mp -99.69 125.65 53.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 CA-C-O 121.388 0.613 . . . . 0.0 110.084 -176.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.9 m -115.22 137.1 52.39 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.7 t-20 -67.15 138.24 56.89 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.76 -20.82 41.83 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.499 0.666 . . . . 0.0 111.263 -177.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -98.83 -47.33 5.33 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.384 -174.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 42.8 p -95.15 -22.59 17.76 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.4 0.619 . . . . 0.0 109.938 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 69.68 21.58 6.51 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 125.394 1.478 . . . . 0.0 111.538 -175.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.52 119.53 12.47 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.669 -1.151 . . . . 0.0 108.419 176.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -90.16 121.02 31.82 Favored 'General case' 0 N--CA 1.411 -2.386 0 CA-C-O 121.522 0.677 . . . . 0.0 110.889 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -93.21 100.77 13.08 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.3 p -100.64 -22.34 14.96 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.768 -175.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' O ' HD23 ' A' ' 31' ' ' LEU . 7.2 t70 -99.94 137.87 37.79 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.625 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.1 m-20 -60.03 -19.55 53.26 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -78.4 -8.73 58.8 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.9 152.16 45.1 Favored 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.518 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.4 138.6 52.98 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 118.604 0.638 . . . . 0.0 112.516 -176.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.21 115.23 38.28 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.57 173.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 47.3 Cg_endo -77.76 151.39 28.15 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.991 2.46 . . . . 0.0 113.016 174.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.588 ' HA ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -67.18 -10.87 54.79 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.973 0.892 . . . . 0.0 113.294 -177.714 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -87.18 -4.77 59.13 Favored 'General case' 0 C--N 1.277 -2.546 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.875 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.6 m -109.73 143.15 39.92 Favored 'General case' 0 N--CA 1.426 -1.648 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.1 m -103.58 129.08 50.75 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 55' ' ' ASN . 29.5 m -124.45 159.59 30.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -174.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -101.39 134.49 41.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.1 t -114.58 114.44 46.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 CA-C-O 121.053 0.454 . . . . 0.0 109.784 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -113.62 132.29 55.81 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.613 -177.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -85.96 121.88 29.22 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.587 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -123.25 147.99 53.67 Favored Pre-proline 0 C--O 1.206 -1.221 0 C-N-CA 120.551 -0.46 . . . . 0.0 109.916 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.31 138.13 38.48 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 121.989 1.793 . . . . 0.0 111.255 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.492 HG22 ' HB2' ' A' ' 50' ' ' ASP . 16.7 pt -71.14 -38.48 71.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.346 176.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.3 -69.47 0.5 Allowed Glycine 0 N--CA 1.435 -1.394 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.641 -176.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -143.11 -5.55 0.72 Allowed Glycine 0 N--CA 1.418 -2.532 0 CA-C-N 114.79 -0.705 . . . . 0.0 112.267 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 82' ' ' ILE . 27.1 m -80.11 95.92 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-O 122.379 1.085 . . . . 0.0 111.528 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 C--N 1.296 -1.72 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.05 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.773 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.493 ' HB2' ' HB2' ' A' ' 5' ' ' SER . 13.7 Cg_exo -71.86 128.91 14.68 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.918 2.412 . . . . 0.0 111.377 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.3 mt -78.36 -63.22 1.45 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 120.951 0.405 . . . . 0.0 111.257 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.77 5.52 84.81 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 113.911 -173.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.493 ' HB2' ' HB2' ' A' ' 2' ' ' PRO . 56.7 m -94.23 5.08 52.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.449 -0.501 . . . . 0.0 112.113 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 97.0 mmm -68.92 136.65 52.91 Favored 'General case' 0 CA--C 1.495 -1.165 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.492 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 18.0 m -80.97 110.63 16.69 Favored 'General case' 0 N--CA 1.402 -2.851 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.113 -171.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -138.69 129.04 25.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.091 -177.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 21' ' ' THR . 51.3 t -107.23 132.12 55.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.502 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 49.4 m-70 -80.8 108.83 14.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.58 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 32.8 p90 -124.37 137.48 54.46 Favored 'General case' 0 C--N 1.281 -2.373 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -120.32 133.29 55.48 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 174.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -88.88 153.71 20.83 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 -177.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.2 p -68.45 -12.45 61.21 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.383 0.611 . . . . 0.0 111.484 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.9 p -87.78 -9.72 53.11 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.307 0.575 . . . . 0.0 109.884 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -113.66 -176.96 3.02 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.3 tp -134.23 -20.69 1.88 Allowed 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.346 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -104.77 157.37 17.24 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.23 147.68 27.86 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.455 175.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 6.9 t70 -123.43 178.69 5.04 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 5.6 p -130.05 115.41 17.06 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 118.551 0.614 . . . . 0.0 110.916 -173.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -95.54 135.62 29.08 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.018 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 7' ' ' SER . 10.0 p -105.46 146.04 30.04 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -174.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.5 p90 -156.51 176.44 12.7 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -113.06 135.0 54.27 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 173.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.53 177.43 16.32 Favored Glycine 0 N--CA 1.425 -2.04 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -81.47 -32.41 32.54 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.64 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -148.99 160.08 43.64 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.973 -175.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.4 tt -126.24 128.01 71.22 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.647 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.008 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.8 m -61.94 147.93 45.28 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.35 0.66 . . . . 0.0 111.093 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 43.5 tp -54.67 -46.34 74.01 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.485 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 16.2 t -56.05 -45.31 79.26 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 120.969 0.414 . . . . 0.0 109.959 179.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.04 -41.23 82.39 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.611 0.719 . . . . 0.0 111.073 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.8 -46.8 87.95 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.555 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HA ' HD23 ' A' ' 51' ' ' LEU . 57.9 mtmt -66.11 -39.39 89.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.828 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 5.7 mptp? -61.63 -39.38 91.1 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.227 0.329 . . . . 0.0 111.488 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -66.62 -47.69 71.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.273 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.11 -47.39 78.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.4 mtm -64.72 -38.26 90.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.908 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.32 -32.01 65.55 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.925 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -71.92 -50.14 31.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.079 0.466 . . . . 0.0 111.327 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.32 -9.75 58.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.486 -173.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm 71.71 62.29 0.15 Allowed 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 125.316 1.446 . . . . 0.0 110.564 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -98.03 158.36 15.59 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.044 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -106.83 104.41 14.09 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 122.171 0.986 . . . . 0.0 109.706 176.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.65 61.8 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.158 -176.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.49 58.09 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.188 0.518 . . . . 0.0 110.782 178.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.596 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 19.2 t70 -117.04 -39.61 3.21 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.727 0.775 . . . . 0.0 110.102 178.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.5 p -138.8 160.81 38.78 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.833 -174.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.482 ' HB2' HG22 ' A' ' 82' ' ' ILE . 33.8 t70 -115.31 167.39 10.9 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 177.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 35' ' ' LYS . 20.0 tp -114.57 109.82 18.85 Favored 'General case' 0 N--CA 1.404 -2.747 0 CA-C-O 121.502 0.668 . . . . 0.0 109.62 -174.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.568 ' HB2' HG12 ' A' ' 80' ' ' ILE . 35.0 tt0 -94.15 120.78 34.88 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -176.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.468 HD11 ' HG ' ' A' ' 51' ' ' LEU . 25.8 mm -109.02 130.87 61.21 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.472 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -176.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.8 m -120.38 147.54 44.92 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.487 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 13.6 t-20 -78.33 138.67 38.68 Favored 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.07 37.77 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.444 0.64 . . . . 0.0 110.933 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -95.79 -51.89 4.31 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.594 -173.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -89.73 -18.27 26.68 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.524 0.678 . . . . 0.0 109.789 -176.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.6 mmmt 65.4 24.13 12.01 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.078 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -84.75 129.45 34.82 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -85.87 127.42 34.58 Favored 'General case' 0 N--CA 1.417 -2.086 0 CA-C-O 121.626 0.727 . . . . 0.0 109.716 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.14 93.91 8.25 Favored 'General case' 0 C--N 1.272 -2.765 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.074 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -88.36 -28.35 21.03 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.342 -1.299 . . . . 0.0 113.446 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -99.9 146.08 27.07 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.6 m-20 -73.34 -5.95 42.98 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.5 -11.76 53.42 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.888 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 31' ' ' LEU . . . -60.71 114.08 2.82 Favored 'General case' 0 C--O 1.203 -1.345 0 O-C-N 124.074 0.859 . . . . 0.0 111.298 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.64 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.9 pp -91.6 138.65 31.4 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.443 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.73 115.6 43.78 Favored Pre-proline 0 C--N 1.301 -1.5 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.669 173.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 71.6 Cg_endo -79.57 158.5 25.31 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.449 2.766 . . . . 0.0 113.232 176.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 7' ' ' SER . 52.5 pttt -68.48 -4.33 14.6 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.617 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -86.74 -11.09 52.12 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.209 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.6 m -118.71 154.33 32.93 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 m -109.37 131.76 54.77 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.47 HG12 ' HA ' ' A' ' 55' ' ' ASN . 19.0 m -126.11 157.44 36.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-O 121.854 0.835 . . . . 0.0 112.882 -175.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mm -99.23 127.25 52.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.435 ' CG1' HD11 ' A' ' 51' ' ' LEU . 58.3 t -108.45 114.31 46.31 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.382 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -118.4 138.64 52.31 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.566 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -93.33 122.92 36.24 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.568 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.7 pp -124.08 153.8 68.05 Favored Pre-proline 0 C--N 1.31 -1.149 0 O-C-N 122.195 -0.315 . . . . 0.0 110.596 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.61 136.2 30.19 Favored 'Trans proline' 0 C--N 1.323 -0.776 0 C-N-CA 121.828 1.685 . . . . 0.0 111.199 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.482 HG22 ' HB2' ' A' ' 50' ' ' ASP . 12.1 pt -72.62 -22.18 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.016 0.436 . . . . 0.0 109.875 176.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 105.35 -34.06 6.07 Favored Glycine 0 N--CA 1.426 -1.972 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.37 -58.81 0.39 Allowed Glycine 0 CA--C 1.482 -2.011 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -177.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.12 124.76 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 172.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 93.4 mttt . . . . . 0 C--N 1.29 -1.999 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.86 -175.573 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.832 0 N-CA-C 110.406 -1.077 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -82.67 158.85 16.48 Favored 'Trans proline' 0 N--CA 1.436 -1.91 0 C-N-CA 122.303 2.002 . . . . 0.0 112.405 -176.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp -111.46 11.24 21.4 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.42 63.89 2.17 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.163 -1.575 . . . . 0.0 109.163 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.0 p -69.49 -24.49 63.77 Favored 'General case' 0 CA--C 1.495 -1.168 0 CA-C-O 121.39 0.614 . . . . 0.0 112.477 -175.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.4 mtp -91.08 86.76 6.32 Favored 'General case' 0 C--N 1.285 -2.235 0 CA-C-O 122.62 1.2 . . . . 0.0 108.137 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.3 m -87.68 122.06 30.89 Favored 'General case' 0 C--N 1.255 -3.506 0 CA-C-N 113.304 -1.771 . . . . 0.0 106.802 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.606 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 19.1 p -133.39 134.6 43.9 Favored 'General case' 0 C--N 1.294 -1.829 0 C-N-CA 120.22 -0.592 . . . . 0.0 111.41 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.5 HG23 ' CE1' ' A' ' 24' ' ' PHE . 52.0 t -107.32 123.42 62.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.861 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -78.3 114.36 17.12 Favored 'General case' 0 N--CA 1.419 -2.001 0 O-C-N 124.152 0.907 . . . . 0.0 108.907 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.524 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 50.0 p90 -125.05 131.94 53.28 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -117.37 131.22 56.82 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 118.404 -1.318 . . . . 0.0 109.304 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.453 ' CB ' ' HD3' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -86.17 156.68 20.23 Favored 'General case' 0 C--N 1.273 -2.748 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -177.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.3 p -60.26 -27.79 67.53 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.243 0.544 . . . . 0.0 110.527 175.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.6 m -96.78 8.43 44.33 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.703 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HD3' ' CB ' ' A' ' 13' ' ' PHE . 5.9 mptp? -108.69 157.16 18.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.11 -34.24 13.04 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.197 0.522 . . . . 0.0 110.52 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -133.37 175.98 8.93 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -77.11 141.82 40.03 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.336 0.589 . . . . 0.0 111.38 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -108.33 177.31 4.83 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 p -136.79 136.47 38.88 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -175.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -98.72 122.27 50.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 167.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.0 p -93.86 123.54 37.28 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.5 ' CE1' HG23 ' A' ' 9' ' ' VAL . 47.0 p90 -140.94 177.36 8.1 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -178.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -120.27 118.59 30.84 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.461 0.573 . . . . 0.0 112.355 -175.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 134.69 -113.89 1.2 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.86 174.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -131.48 -45.23 0.99 Allowed 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.613 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -141.18 161.66 37.35 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.8 tt -125.16 127.75 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.133 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.8 m -58.83 137.92 57.51 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.525 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.441 HD11 ' CG1' ' A' ' 53' ' ' ILE . 53.2 tp -54.79 -41.7 70.88 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 124.432 1.093 . . . . 0.0 112.672 -175.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 8.1 t -57.42 -45.42 84.64 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 12.2 t70 -66.41 -42.36 87.9 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -64.94 -46.87 79.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.883 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.564 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 41.3 mtmt -69.04 -37.89 78.84 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.813 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.7 mptt -61.84 -39.49 92.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.003 177.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ASP . 74.7 mt-30 -64.02 -50.88 66.71 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.018 177.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.79 -46.59 96.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.854 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG2' HD22 ' A' ' 44' ' ' LEU . 67.3 mtm -64.92 -38.34 90.63 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.879 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.86 -33.31 57.84 Favored Glycine 0 C--N 1.315 -0.636 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.156 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -72.96 -48.49 36.26 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 123.463 0.705 . . . . 0.0 112.013 -177.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -95.47 -0.45 52.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.166 0.508 . . . . 0.0 112.125 -173.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.419 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 44.5 mmtt 67.35 68.23 0.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.904 177.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD22 ' HG2' ' A' ' 39' ' ' MET . 11.1 mp -98.1 170.74 8.7 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.075 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -109.88 101.7 10.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.501 0.667 . . . . 0.0 110.106 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.15 -9.04 59.87 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 123.683 0.793 . . . . 0.0 111.271 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.3 -5.63 54.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.496 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.8 t70 -131.54 -29.82 1.72 Allowed 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.06 0.933 . . . . 0.0 110.814 -176.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.5 m -130.01 159.35 36.96 Favored 'General case' 0 N--CA 1.399 -3.004 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -176.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.628 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 5.7 t0 -118.36 169.56 9.64 Favored 'General case' 0 C--N 1.287 -2.119 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 175.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.564 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 24.0 tp -114.15 119.02 35.68 Favored 'General case' 0 C--N 1.248 -3.812 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.502 ' HB2' HG12 ' A' ' 80' ' ' ILE . 34.5 tt0 -113.22 117.2 31.21 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 -175.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.441 ' CG1' HD11 ' A' ' 31' ' ' LEU . 39.2 mm -99.91 135.55 35.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.695 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -176.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 m -123.65 145.36 49.01 Favored 'General case' 0 C--N 1.287 -2.145 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.3 t-20 -71.17 139.29 50.14 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.766 -0.584 . . . . 0.0 109.915 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.22 56.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.921 0.391 . . . . 0.0 111.336 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -94.69 -48.29 6.13 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.69 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.2 p -95.31 -19.24 20.14 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.769 -174.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 59.58 41.62 18.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -94.94 126.63 40.4 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -80.87 135.42 35.92 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-O 120.848 0.356 . . . . 0.0 110.238 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -94.0 100.45 12.58 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -83.2 -47.32 11.69 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.682 -1.145 . . . . 0.0 114.06 -170.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -90.97 147.48 23.07 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -78.11 -1.43 32.45 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.298 0.57 . . . . 0.0 112.306 -176.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -92.79 -2.43 55.96 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.943 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.55 148.64 51.39 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 174.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.613 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.6 pp -118.91 138.76 52.54 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 118.237 0.471 . . . . 0.0 111.634 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.26 117.25 36.81 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.239 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.4 Cg_endo -78.34 154.43 28.2 Favored 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 123.779 2.986 . . . . 0.0 114.514 177.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -65.05 -10.52 30.69 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.397 1.079 . . . . 0.0 111.776 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.57 -10.46 51.5 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.049 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.9 m -107.57 155.37 20.19 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 121.291 0.567 . . . . 0.0 111.435 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -118.85 132.91 56.13 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 173.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 55' ' ' ASN . 18.8 m -128.64 162.38 35.64 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.327 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.0 mm -104.45 132.84 50.12 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.484 ' CG1' HD11 ' A' ' 51' ' ' LEU . 42.8 t -106.46 113.96 44.43 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.178 0 CA-C-O 121.206 0.526 . . . . 0.0 110.015 -178.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 24.8 tpp180 -110.38 125.11 52.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.102 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -90.28 120.21 31.23 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 174.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.502 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.03 152.25 50.08 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.683 -176.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -76.8 140.85 21.08 Favored 'Trans proline' 0 C--O 1.245 0.856 0 C-N-CA 122.212 1.941 . . . . 0.0 111.053 176.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.628 ' CG2' ' HB2' ' A' ' 50' ' ' ASP . 23.9 pt -95.07 -32.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.51 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.91 -25.0 1.53 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 -173.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.49 ' H ' ' C ' ' A' ' 82' ' ' ILE . . . 108.49 5.29 32.08 Favored Glycine 0 N--CA 1.415 -2.701 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -176.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.42 86.97 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.249 1.037 0 CA-C-O 121.805 0.812 . . . . 0.0 111.794 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--N 1.299 -1.6 0 N-CA-C 106.44 -1.689 . . . . 0.0 106.44 176.768 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.737 0 N-CA-C 110.459 -1.057 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.53 -70.76 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.662 2.242 . . . . 0.0 111.875 -178.293 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 81.9 mt -125.91 155.51 41.15 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.39 48.04 20.12 Favored Glycine 0 N--CA 1.442 -0.929 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -175.432 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.1 m -144.83 35.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.042 -0.579 . . . . 0.0 109.748 -176.327 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.24 149.35 45.74 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.924 0.869 . . . . 0.0 112.214 178.071 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -102.71 127.17 49.95 Favored 'General case' 0 C--N 1.28 -2.442 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.94 -175.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.6 p -137.36 138.9 40.4 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.528 -179.297 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.554 HG23 ' HE1' ' A' ' 24' ' ' PHE . 41.5 t -107.38 134.98 47.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.467 -179.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -82.95 109.68 17.27 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 174.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 36.6 p90 -122.5 134.4 54.57 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -115.74 132.11 56.73 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 117.744 -1.583 . . . . 0.0 109.174 175.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.31 155.65 17.4 Favored 'General case' 0 C--N 1.275 -2.645 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -62.62 -25.8 68.29 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.578 0.704 . . . . 0.0 110.655 175.601 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.7 m -81.1 -3.09 50.83 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.984 178.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -106.31 172.39 6.84 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.8 tp -102.1 -45.8 5.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 176.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -122.69 -171.01 2.19 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.167 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.9 148.1 34.73 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.496 0.665 . . . . 0.0 111.623 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -114.45 178.51 4.26 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 176.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 3.1 p -132.17 131.97 42.75 Favored 'General case' 0 N--CA 1.414 -2.242 0 CA-C-N 118.908 0.776 . . . . 0.0 110.64 -175.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.6 p -110.2 130.77 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.191 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 176.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -102.03 141.94 34.1 Favored 'General case' 0 C--N 1.294 -1.819 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -174.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 9' ' ' VAL . 24.9 p90 -155.76 177.38 11.46 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -116.86 155.49 28.93 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.13 -135.64 12.96 Favored Glycine 0 C--N 1.31 -0.912 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 -178.715 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.451 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 2.8 tm? -122.9 -42.84 2.27 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.489 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -136.29 159.01 43.05 Favored 'General case' 0 CA--C 1.478 -1.804 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.662 -177.274 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 12.8 tt -121.21 126.71 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.638 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.5 m -57.64 140.53 50.91 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.178 176.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 62' ' ' TYR . 50.1 tp -57.87 -40.26 79.78 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 123.17 0.588 . . . . 0.0 112.491 -176.319 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.686 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 19.7 t -55.18 -46.92 75.84 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 176.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.622 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -66.03 -47.7 73.56 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.74 179.611 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.91 -46.61 89.97 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 123.561 0.538 . . . . 0.0 112.14 -177.066 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' HD23 ' A' ' 51' ' ' LEU . 50.1 mtmt -66.08 -45.13 82.34 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.302 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.686 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.1 mptt -62.0 -35.56 78.89 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.271 0.357 . . . . 0.0 111.1 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 29.3 mm-40 -63.7 -50.6 68.55 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.425 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.6 mt -66.25 -45.57 89.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.566 -176.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 44' ' ' LEU . 67.8 mtm -64.66 -40.5 95.54 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.278 -177.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.04 -41.59 47.43 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.235 179.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.63 -47.37 63.65 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 17.6 mm-40 -89.55 -2.74 58.43 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt 71.21 65.92 0.16 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 125.153 1.381 . . . . 0.0 111.288 178.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.436 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 9.9 mp -103.38 156.99 17.34 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.124 -0.944 . . . . 0.0 108.582 175.516 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -94.31 100.62 12.63 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 122.005 0.907 . . . . 0.0 109.782 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.08 -17.04 61.0 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.108 -174.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -98.2 1.73 47.66 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 179.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -124.3 -28.17 3.7 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.232 -0.987 . . . . 0.0 111.581 -177.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.4 p -135.68 159.65 40.98 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.716 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -108.47 157.34 18.53 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -179.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.455 HD11 ' CG1' ' A' ' 77' ' ' VAL . 23.6 tp -113.1 116.62 30.16 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.067 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.497 ' HB2' HG12 ' A' ' 80' ' ' ILE . 25.1 tt0 -116.21 115.08 25.35 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 121.806 0.812 . . . . 0.0 109.645 -176.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.425 HD12 HG22 ' A' ' 77' ' ' VAL . 27.4 mm -97.25 135.55 31.11 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 -174.293 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 m -121.19 141.36 50.93 Favored 'General case' 0 C--N 1.283 -2.294 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.467 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 12.4 t-20 -75.1 139.75 42.98 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.677 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.0 -28.54 39.42 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.336 0.589 . . . . 0.0 111.173 -179.716 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -92.09 -49.18 6.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.425 -174.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.1 p -93.64 -19.79 20.8 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.982 0.42 . . . . 0.0 110.129 -174.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 31.2 mmmt 65.75 24.01 11.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.559 1.144 . . . . 0.0 111.139 -178.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -82.29 131.3 35.23 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -90.36 135.27 33.79 Favored 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 177.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 63.2 m-85 -101.25 97.12 7.67 Favored 'General case' 0 C--N 1.263 -3.19 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.223 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -100.15 -25.39 14.3 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.985 -177.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -94.07 128.99 40.77 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -176.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 1.2 m-20 -61.6 -10.74 8.9 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -91.68 -2.08 57.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.637 -178.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.29 151.14 47.35 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.2 pp -119.16 138.94 52.59 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 118.385 0.539 . . . . 0.0 111.007 -177.642 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.48 113.98 36.45 Favored Pre-proline 0 C--N 1.315 -0.93 0 C-N-CA 119.689 -0.805 . . . . 0.0 110.445 173.027 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.564 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.7 Cg_endo -79.43 158.68 25.79 Favored 'Trans proline' 0 CA--C 1.519 -0.256 0 C-N-CA 123.128 2.552 . . . . 0.0 113.245 177.032 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.486 ' HD3' HD22 ' A' ' 72' ' ' ASN . 0.0 OUTLIER -70.48 5.15 1.92 Allowed 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 121.57 0.7 . . . . 0.0 111.9 176.339 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.486 HD22 ' HD3' ' A' ' 71' ' ' LYS . 1.0 OUTLIER -87.95 -20.52 25.78 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.023 172.891 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -103.42 141.7 35.52 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -174.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.4 m -104.0 128.43 51.56 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 169.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 ' HA ' ' A' ' 55' ' ' ASN . 14.6 m -123.17 157.28 28.87 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.7 mm -103.71 125.96 58.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.455 ' CG1' HD11 ' A' ' 51' ' ' LEU . 46.4 t -100.78 114.27 39.26 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-O 121.397 0.617 . . . . 0.0 110.429 -177.515 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -113.11 138.85 49.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.887 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -100.41 128.52 46.45 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.497 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.3 pp -127.85 153.61 78.09 Favored Pre-proline 0 C--N 1.312 -1.036 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.28 134.31 24.57 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 121.977 1.784 . . . . 0.0 111.993 179.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 pt -65.81 -30.78 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-O 121.077 0.465 . . . . 0.0 111.644 178.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 106.23 -62.06 0.33 Allowed Glycine 0 N--CA 1.425 -2.064 0 C-N-CA 121.018 -0.61 . . . . 0.0 111.86 179.712 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -96.31 80.3 0.75 Allowed Glycine 0 N--CA 1.428 -1.899 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.011 -178.227 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.7 m -76.78 86.42 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-O 122.428 1.109 . . . . 0.0 110.621 177.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.1 pttm . . . . . 0 C--N 1.302 -1.495 0 CA-C-N 113.561 -1.654 . . . . 0.0 112.051 -178.507 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.366 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -79.02 3.37 7.47 Favored 'Trans proline' 0 C--O 1.245 0.83 0 C-N-CA 123.308 2.672 . . . . 0.0 112.885 -179.022 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 91.3 mt 69.76 -82.73 0.03 OUTLIER 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.259 1.424 . . . . 0.0 111.171 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -146.77 141.13 9.18 Favored Glycine 0 N--CA 1.424 -2.13 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.275 -179.637 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.2 m -75.54 -21.83 57.59 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-O 121.771 0.796 . . . . 0.0 110.263 178.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 86.5 mtp -77.25 105.7 8.52 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 172.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 71' ' ' LYS . 36.1 m -102.12 140.07 36.9 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.118 -172.18 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 20.7 p -139.59 134.84 32.68 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.629 -179.034 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.532 HG23 ' CE1' ' A' ' 24' ' ' PHE . 59.6 t -107.35 135.67 45.12 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.458 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -83.92 113.32 20.89 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.195 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 29.5 p90 -129.51 136.56 50.0 Favored 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.218 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.8 pttp -121.79 141.01 51.64 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 173.273 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.559 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -91.66 175.87 6.74 Favored 'General case' 0 C--N 1.277 -2.566 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 177.059 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -63.43 -30.65 71.74 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 171.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.4 m -79.53 -7.04 58.2 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.682 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.559 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 3.8 mptp? -105.06 134.25 48.48 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.302 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.27 -19.47 22.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.629 0.728 . . . . 0.0 109.226 178.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.449 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 8.2 p30 -129.96 173.92 10.25 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.553 179.012 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.89 129.05 36.96 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.268 0.556 . . . . 0.0 112.179 -177.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -89.58 177.59 6.51 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.55 -1.205 . . . . 0.0 108.47 175.092 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -135.76 131.49 35.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.169 0.509 . . . . 0.0 110.87 -177.238 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 9.5 p -113.75 127.54 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.086 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 7' ' ' SER . 8.5 p -99.83 143.69 29.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.374 0.606 . . . . 0.0 112.142 -176.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.532 ' CE1' HG23 ' A' ' 9' ' ' VAL . 17.2 p90 -153.23 171.03 19.14 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.157 178.014 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.14 135.33 51.82 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.12 -115.02 2.08 Favored Glycine 0 C--N 1.302 -1.341 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tt -149.14 -41.11 0.15 Allowed 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.608 ' CG ' HD13 ' A' ' 68' ' ' LEU . 1.1 p-80 -134.81 157.25 47.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 179.521 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 tt -122.78 125.67 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.993 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.553 -179.014 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.1 m -58.23 141.25 51.29 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.908 173.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.449 HD11 HD13 ' A' ' 53' ' ' ILE . 57.9 tp -54.63 -41.23 69.78 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.918 1.287 . . . . 0.0 111.409 -177.435 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.654 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 53.7 t -54.33 -45.24 72.63 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.452 178.198 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -72.63 -43.07 63.72 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 -176.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.499 ' CD2' HD13 ' A' ' 69' ' ' ILE . 0.6 OUTLIER -67.02 -40.85 87.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.24 -174.477 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.456 ' HD2' ' HB3' ' A' ' 51' ' ' LEU . 53.1 mtmt -62.36 -38.82 91.0 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.782 -179.431 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.654 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 3.9 mptp? -61.75 -40.42 95.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.638 177.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -63.18 -51.1 67.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.783 179.435 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 73.6 mt -68.81 -42.83 82.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.418 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.428 ' HG3' HD22 ' A' ' 51' ' ' LEU . 72.2 mtm -64.0 -35.25 80.07 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.384 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.5 -39.16 50.87 Favored Glycine 0 C--N 1.309 -0.924 0 C-N-CA 120.308 -0.948 . . . . 0.0 111.541 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -66.77 -43.41 84.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.893 0.877 . . . . 0.0 112.549 -177.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 76.5 mm-40 -99.95 3.61 44.46 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.882 0.373 . . . . 0.0 110.993 -178.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.4 mptt 57.86 66.51 1.11 Allowed 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.387 178.11 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.4 mp -98.85 154.23 18.18 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.179 177.564 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' A' ' 47' ' ' ALA . 23.7 ttmm -97.69 111.62 23.83 Favored 'General case' 0 N--CA 1.401 -2.893 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.98 -1.69 26.89 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.794 -178.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.33 -12.06 18.94 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.377 -177.038 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.89 -37.06 6.8 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.392 0.615 . . . . 0.0 110.323 -177.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.7 m -141.43 174.36 10.62 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.441 -178.442 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.514 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 6.3 t0 -119.44 169.87 9.65 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.9 tp -114.52 122.26 46.02 Favored 'General case' 0 C--N 1.273 -2.76 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -113.55 123.34 49.76 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -177.113 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.498 HG12 HD11 ' A' ' 34' ' ' LEU . 2.1 mp -102.94 132.11 49.8 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.84 0 C-N-CA 119.867 -0.733 . . . . 0.0 109.115 179.204 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.4 m -117.27 146.92 42.99 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 179.376 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.542 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.7 t-20 -74.59 138.6 43.11 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' HG13 ' A' ' 76' ' ' ILE . . . -76.88 -25.77 53.43 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-O 121.211 0.529 . . . . 0.0 110.379 -178.419 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -92.78 -56.52 2.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.553 -176.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.5 p -90.83 -16.27 28.57 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.248 -171.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 mptt 64.03 18.44 11.22 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -174.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.18 125.89 28.08 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 175.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -89.51 125.67 35.28 Favored 'General case' 0 C--N 1.288 -2.094 0 CA-C-O 121.298 0.57 . . . . 0.0 110.676 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -92.61 100.15 12.73 Favored 'General case' 0 C--N 1.278 -2.507 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.4 p -98.2 -26.09 14.67 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.743 -175.577 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -95.35 135.54 36.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB3' ' HB2' ' A' ' 32' ' ' CYS . 4.2 m-20 -64.19 -17.85 63.93 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.493 0.717 . . . . 0.0 110.784 -178.073 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -81.64 -8.75 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.727 -178.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.83 144.36 56.66 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.624 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.608 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.73 137.68 52.53 Favored 'General case' 0 C--N 1.294 -1.835 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -176.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.499 HD13 ' CD2' ' A' ' 34' ' ' LEU . 3.8 mp -119.69 116.48 33.16 Favored Pre-proline 0 C--N 1.302 -1.477 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.236 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.525 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 75.8 Cg_endo -80.75 160.8 21.64 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.373 2.716 . . . . 0.0 113.879 177.735 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 7' ' ' SER . 53.4 pttt -63.79 -8.74 11.58 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.93 175.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -81.48 -17.38 48.88 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.646 178.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 37.8 m -105.81 152.74 22.85 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.784 0.802 . . . . 0.0 111.856 -175.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 m -114.45 129.75 56.68 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 170.184 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.652 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 25.6 m -128.57 164.28 30.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 120.909 0.385 . . . . 0.0 110.917 -176.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 56' ' ' ALA . 51.0 mt -122.8 129.04 75.43 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 53' ' ' ILE . 20.3 t -100.39 132.62 45.67 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.468 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.089 -173.091 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -130.26 143.16 50.61 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 -176.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -97.36 134.07 41.12 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 pp -124.77 148.9 60.88 Favored Pre-proline 0 C--N 1.303 -1.429 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.934 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.61 132.27 18.59 Favored 'Trans proline' 0 N--CA 1.447 -1.254 0 C-N-CA 122.188 1.925 . . . . 0.0 111.713 178.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.524 HG13 ' H ' ' A' ' 84' ' ' GLY . 31.5 pt -84.01 -22.43 8.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.392 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 137.2 -27.78 2.85 Favored Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.524 ' H ' HG13 ' A' ' 82' ' ' ILE . . . 137.21 178.32 15.79 Favored Glycine 0 N--CA 1.412 -2.96 0 N-CA-C 108.666 -1.774 . . . . 0.0 108.666 -179.873 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 65.5 t -78.3 97.85 2.3 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.907 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.478 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.6 pttt . . . . . 0 C--N 1.302 -1.486 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.164 -177.634 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.331 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -62.02 -53.56 2.0 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 123.151 2.567 . . . . 0.0 113.21 -177.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 pp -73.36 -25.42 60.58 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.463 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.57 85.17 0.27 Allowed Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 178.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.7 m -85.3 76.05 10.18 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-O 121.71 0.767 . . . . 0.0 110.05 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 85.9 mtp -80.75 162.49 24.07 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.587 179.548 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.4 m -115.04 116.46 28.48 Favored 'General case' 0 N--CA 1.405 -2.684 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.543 ' SG ' HG22 ' A' ' 23' ' ' THR . 83.8 m -138.38 133.51 33.0 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.917 -174.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.55 HG23 ' CE1' ' A' ' 24' ' ' PHE . 79.1 t -106.14 130.52 57.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 42.7 m-70 -88.63 120.17 29.78 Favored 'General case' 0 CA--C 1.482 -1.652 0 O-C-N 124.227 0.954 . . . . 0.0 109.106 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.632 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 35.1 p90 -132.95 139.93 47.56 Favored 'General case' 0 C--N 1.278 -2.515 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.22 148.49 43.62 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.536 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -85.97 165.45 16.72 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.957 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -66.08 -30.9 71.5 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.2 t -74.34 -57.11 4.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.87 176.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 13' ' ' PHE . 54.5 mtmt -67.4 143.22 56.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.094 0.557 . . . . 0.0 111.7 -178.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.15 -37.65 14.05 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.162 -175.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -100.76 163.23 12.42 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.528 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -87.94 152.17 22.26 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.374 0.607 . . . . 0.0 111.553 -177.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.47 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 7.8 t70 -121.71 176.69 5.59 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 176.449 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 4.6 p -133.33 131.17 39.81 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 2.6 m -95.5 117.33 39.26 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.165 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 170.157 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.543 HG22 ' SG ' ' A' ' 8' ' ' CYS . 39.9 p -86.01 121.41 28.59 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.406 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.566 ' O ' ' HB2' ' A' ' 7' ' ' SER . 16.0 p90 -143.24 161.6 37.85 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -178.106 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -101.13 132.51 46.57 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.0 -163.39 23.49 Favored Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -177.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 58.0 tp -106.97 -35.52 6.88 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 176.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.532 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -144.3 156.94 44.48 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.261 -179.242 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 8.8 tt -126.14 131.15 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.91 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.432 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.8 m -64.98 145.54 56.2 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.131 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 47.6 tp -54.87 -46.27 74.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -172.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.491 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 12.7 t -58.57 -42.73 88.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 118.994 0.815 . . . . 0.0 109.87 179.412 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 6.1 m-20 -65.06 -43.51 92.0 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.132 179.193 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.29 -46.34 90.17 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.893 -179.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 52.4 mtmt -66.78 -40.57 88.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 -179.92 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.2 mptt -61.87 -34.41 75.96 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.668 178.116 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 13.3 mm100 -65.4 -50.1 66.75 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 110.102 176.115 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.3 mt -68.61 -47.13 78.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.604 -176.689 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 71.0 mtm -63.09 -44.3 96.11 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.17 -178.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -39.03 91.56 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.834 179.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.03 -51.51 63.84 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.085 0.469 . . . . 0.0 110.745 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -97.43 11.26 37.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -171.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt 67.67 38.89 2.88 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.426 1.09 . . . . 0.0 112.036 171.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.07 167.34 22.05 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.388 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -105.47 102.43 11.9 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.681 178.762 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.62 -13.7 60.04 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.52 -176.792 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.58 -6.85 59.12 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.871 -179.1 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.535 ' O ' HG12 ' A' ' 82' ' ' ILE . 32.0 t70 -126.62 -33.08 2.57 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.511 0.672 . . . . 0.0 111.107 178.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.3 m -129.27 161.71 29.58 Favored 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.337 -175.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.453 ' HB2' ' CG2' ' A' ' 82' ' ' ILE . 10.5 t70 -118.81 171.26 8.34 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 178.171 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.464 HD11 ' CG1' ' A' ' 77' ' ' VAL . 18.2 tp -118.48 117.69 29.71 Favored 'General case' 0 N--CA 1.395 -3.193 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -174.067 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.562 HE21 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -101.4 123.53 45.62 Favored 'General case' 0 C--N 1.284 -2.249 0 O-C-N 120.932 -1.105 . . . . 0.0 108.408 -177.714 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 51' ' ' LEU . 32.8 mm -110.23 130.67 63.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -173.222 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.7 m -117.13 139.48 50.68 Favored 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.371 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 75' ' ' VAL . 14.8 t-20 -65.79 136.5 56.28 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 176.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.33 -26.18 55.51 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.254 0.549 . . . . 0.0 111.427 -177.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -95.69 -52.2 4.2 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.28 -176.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -90.16 -18.61 25.47 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.25 0.548 . . . . 0.0 110.223 -174.112 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.7 mmmm 66.05 21.83 11.21 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.731 1.212 . . . . 0.0 112.153 -177.239 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -70.72 121.63 18.32 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.597 174.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -90.18 117.98 29.35 Favored 'General case' 0 N--CA 1.405 -2.723 0 CA-C-O 122.0 0.905 . . . . 0.0 110.838 -178.06 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -87.63 92.84 9.25 Favored 'General case' 0 C--N 1.272 -2.767 0 CA-C-N 114.101 -1.408 . . . . 0.0 107.75 -179.583 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.8 p -93.23 -17.77 23.28 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.375 -176.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -101.55 128.82 47.63 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.388 -178.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 7.8 p-10 -67.72 -7.08 24.23 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -90.79 -2.87 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.447 176.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.2 150.56 47.34 Favored 'General case' 0 C--O 1.206 -1.205 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.203 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.532 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.5 pp -118.04 138.33 52.29 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 118.085 0.402 . . . . 0.0 110.84 -177.071 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.28 116.04 37.63 Favored Pre-proline 0 C--N 1.314 -0.956 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.563 176.11 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 73.0 Cg_endo -79.39 158.77 25.96 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 123.162 2.574 . . . . 0.0 113.418 176.036 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -66.67 -10.26 44.49 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.659 178.194 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -87.77 -3.88 58.92 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.386 178.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -112.59 150.88 30.76 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 121.261 0.553 . . . . 0.0 111.476 -178.091 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 p -109.73 126.7 54.0 Favored 'General case' 0 N--CA 1.419 -2.001 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 13.9 m -124.57 164.77 22.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.424 0.63 . . . . 0.0 112.553 -176.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -124.3 136.07 61.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 C-N-CA 124.295 1.038 . . . . 0.0 108.728 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.464 ' CG1' HD11 ' A' ' 51' ' ' LEU . 41.2 t -104.17 129.28 56.69 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.612 -172.323 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -129.01 140.65 51.55 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -98.64 131.94 44.43 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.607 178.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -128.93 152.84 79.82 Favored Pre-proline 0 C--O 1.206 -1.199 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.029 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -74.0 134.69 20.01 Favored 'Trans proline' 0 C--N 1.318 -1.069 0 C-N-CA 122.308 2.006 . . . . 0.0 111.579 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 48' ' ' ASP . 10.6 pt -66.65 -41.11 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.022 178.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.33 -45.23 25.26 Favored Glycine 0 N--CA 1.44 -1.097 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 109.06 -87.56 0.48 Allowed Glycine 0 C--N 1.304 -1.231 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.701 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.5 t -75.13 110.05 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 -179.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 C--N 1.293 -1.854 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 178.226 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.229 0 CA-C-O 119.177 -0.791 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -63.61 -40.97 27.22 Favored 'Trans proline' 0 C--N 1.361 1.197 0 C-N-CA 122.853 2.369 . . . . 0.0 112.723 -178.664 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.9 tp -158.64 99.73 1.59 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.071 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.77 9.75 5.21 Favored Glycine 0 C--N 1.301 -1.363 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.485 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.6 m 62.53 85.31 0.13 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 110.902 -177.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.2 mtp -65.76 115.93 6.42 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.688 177.372 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.474 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . 64.1 m -89.82 135.52 33.58 Favored 'General case' 0 N--CA 1.412 -2.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.497 -178.663 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 27.3 p -144.25 144.48 31.53 Favored 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.531 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.2 t -105.57 132.43 52.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.331 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -82.84 104.7 13.26 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CD2' HG21 ' A' ' 77' ' ' VAL . 38.2 p90 -120.71 141.23 50.62 Favored 'General case' 0 C--N 1.28 -2.443 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 -177.426 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -124.51 126.09 45.29 Favored 'General case' 0 C--N 1.289 -2.052 0 C-N-CA 118.102 -1.439 . . . . 0.0 110.164 175.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.26 157.2 19.99 Favored 'General case' 0 C--N 1.286 -2.166 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 178.176 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.7 m -60.0 -25.06 64.97 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 120.809 0.338 . . . . 0.0 111.53 177.479 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.2 t -95.1 -4.75 45.69 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 121.549 0.69 . . . . 0.0 110.615 178.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.24 -43.3 11.08 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 121.712 -0.618 . . . . 0.0 110.642 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 71.89 -47.31 0.66 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.478 1.511 . . . . 0.0 111.722 -176.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -100.92 169.44 8.97 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 175.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -83.36 144.96 29.31 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.536 0.684 . . . . 0.0 112.059 -176.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -113.91 177.97 4.45 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 176.012 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.68 123.0 17.05 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 118.519 0.599 . . . . 0.0 110.875 -174.005 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 10.0 p -102.36 119.68 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 176.696 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 p -87.58 134.52 33.61 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.138 -178.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.531 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.7 p90 -144.79 176.0 9.77 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.715 -177.287 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -103.9 131.19 51.37 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.73 179.83 20.88 Favored Glycine 0 C--O 1.209 -1.407 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.338 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -83.49 -31.62 26.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.54 ' CG ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -136.93 157.35 46.95 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.58 -177.862 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.06 132.48 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.783 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.573 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.461 ' HB2' ' OD2' ' A' ' 33' ' ' ASP . 6.3 m -60.83 145.49 49.72 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.408 0.683 . . . . 0.0 109.976 177.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 56.9 tp -57.7 -43.1 84.94 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 124.134 0.974 . . . . 0.0 112.729 -176.306 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 17.5 t -59.13 -45.6 90.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.636 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 14.1 m-20 -62.71 -48.77 77.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.824 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tt -60.13 -46.54 89.32 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.405 -176.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 39' ' ' MET . 45.6 mtmt -65.46 -44.41 87.29 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.602 -179.151 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 13.3 mptt -61.92 -33.45 74.28 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 116.72 -0.218 . . . . 0.0 111.263 178.251 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' ' O ' ' A' ' 33' ' ' ASP . 24.5 mm-40 -63.76 -49.83 71.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 79.9 mt -67.4 -49.43 71.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.439 -177.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 35' ' ' LYS . 93.6 mtp -61.68 -44.91 96.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.497 -175.282 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.0 -31.72 61.54 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.305 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -72.74 -51.03 20.87 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.32 0.581 . . . . 0.0 111.628 -177.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -87.04 -9.47 55.41 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -170.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt 76.66 67.06 0.05 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 124.683 1.193 . . . . 0.0 111.654 -179.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -104.12 129.48 51.83 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 173.684 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.57 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 23.9 ttmm -77.67 112.7 14.76 Favored 'General case' 0 N--CA 1.408 -2.573 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.256 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.2 -0.9 30.27 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.079 -178.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.452 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -103.03 3.24 35.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.487 0.66 . . . . 0.0 109.297 178.849 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.57 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 23.0 t70 -118.59 -51.13 2.4 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.407 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 93.3 m -134.05 168.04 19.54 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.064 179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -113.6 169.47 8.95 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 -179.773 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.563 HD11 ' CG1' ' A' ' 77' ' ' VAL . 26.2 tp -116.78 125.32 51.44 Favored 'General case' 0 C--N 1.271 -2.832 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.567 ' HB2' HG12 ' A' ' 80' ' ' ILE . 36.1 tt0 -115.99 136.5 52.98 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -179.576 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.468 HD12 HG22 ' A' ' 77' ' ' VAL . 39.0 mm -121.87 135.59 61.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -176.428 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.2 m -128.77 144.51 51.19 Favored 'General case' 0 C--O 1.196 -1.741 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 176.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.539 ' HA ' HG12 ' A' ' 75' ' ' VAL . 11.6 t-20 -72.95 138.43 46.11 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.737 -0.602 . . . . 0.0 109.869 179.679 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.86 -26.19 49.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.237 0.541 . . . . 0.0 111.015 -179.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -94.69 -52.41 4.3 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.475 -176.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 p -90.88 -16.27 28.47 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.202 0.525 . . . . 0.0 110.47 -172.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.5 mmmm 66.01 21.79 11.26 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.962 -179.522 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -83.61 130.92 34.99 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.417 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.25 143.94 33.29 Favored 'General case' 0 N--CA 1.416 -2.14 0 CA-C-O 121.024 0.44 . . . . 0.0 110.151 174.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 31' ' ' LEU . 91.7 m-85 -103.92 99.06 8.82 Favored 'General case' 0 C--N 1.273 -2.74 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.04 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.2 p -91.32 -27.24 18.52 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.804 -173.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -101.34 143.58 31.21 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.5 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 32' ' ' CYS . 3.3 p-10 -74.35 -11.07 60.15 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.733 0.301 . . . . 0.0 111.785 -177.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -3.46 58.83 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.703 178.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.43 140.86 58.66 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 174.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.54 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.7 pp -117.52 137.74 52.36 Favored 'General case' 0 C--N 1.289 -2.051 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.338 -174.685 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.27 117.37 34.91 Favored Pre-proline 0 C--N 1.306 -1.303 0 C-N-CA 119.616 -0.833 . . . . 0.0 110.551 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 55.7 Cg_endo -76.86 152.76 32.62 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.374 2.716 . . . . 0.0 113.244 175.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.474 ' HD3' ' CB ' ' A' ' 7' ' ' SER . 42.4 pttt -57.69 -22.2 44.84 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -86.95 -1.75 58.08 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 120.961 0.41 . . . . 0.0 111.756 -177.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -106.9 147.23 30.05 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 -178.424 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.4 p -109.13 124.39 50.73 Favored 'General case' 0 N--CA 1.424 -1.727 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 55' ' ' ASN . 15.9 m -123.39 149.98 27.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.569 0.7 . . . . 0.0 112.65 -177.44 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.6 mm -94.18 126.07 46.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 178.876 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.563 ' CG1' HD11 ' A' ' 51' ' ' LEU . 59.7 t -106.51 122.03 59.88 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.363 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -177.152 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -126.04 134.41 51.44 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.24 -173.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -90.27 116.78 28.5 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.419 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -118.77 150.52 48.54 Favored Pre-proline 0 C--N 1.308 -1.226 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.276 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.33 138.43 42.77 Favored 'Trans proline' 0 C--N 1.325 -0.668 0 C-N-CA 122.182 1.922 . . . . 0.0 111.876 -179.086 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.2 pt -73.82 -28.87 24.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.5 -86.64 0.66 Allowed Glycine 0 N--CA 1.41 -3.033 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -175.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -147.28 1.54 0.76 Allowed Glycine 0 N--CA 1.425 -2.048 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.748 179.478 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 8.1 m -77.84 86.46 0.98 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 122.388 1.089 . . . . 0.0 112.673 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.7 mttm . . . . . 0 C--N 1.293 -1.88 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 178.505 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.495 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -83.28 99.16 0.85 Allowed 'Trans proline' 0 N--CA 1.437 -1.801 0 C-N-CA 122.089 1.859 . . . . 0.0 111.228 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 pp -96.44 7.75 45.74 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-O 122.051 0.929 . . . . 0.0 110.567 -179.179 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.23 -95.82 0.12 Allowed Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.795 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.7 m -125.84 98.76 5.67 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.028 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.6 mtp -63.98 137.26 57.92 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.785 -175.652 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 m -76.07 135.03 39.9 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.534 -179.173 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 26.9 p -149.6 145.29 26.7 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 119.681 -0.808 . . . . 0.0 110.896 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' CE1' ' A' ' 24' ' ' PHE . 91.0 t -107.02 128.74 61.63 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.341 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.444 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 21.6 m-70 -77.68 105.54 8.91 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 173.89 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.559 ' HA ' ' O ' ' A' ' 75' ' ' VAL . 33.7 p90 -123.41 140.82 52.62 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -178.305 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 pttp -117.02 137.77 52.02 Favored 'General case' 0 C--N 1.286 -2.182 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 172.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.459 ' H ' ' HB2' ' A' ' 16' ' ' LYS . 2.2 t80 -89.9 166.69 13.35 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -178.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.4 t -58.94 -31.5 68.74 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.627 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 m -84.6 -7.07 59.38 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.31 -179.982 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.459 ' HB2' ' H ' ' A' ' 13' ' ' PHE . 95.6 mttt -116.87 124.38 49.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.422 0.629 . . . . 0.0 110.67 -177.12 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -81.93 -20.57 38.4 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.651 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -114.01 164.69 13.47 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.372 -0.831 . . . . 0.0 108.8 179.852 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -83.94 148.22 27.04 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 121.87 0.843 . . . . 0.0 111.601 -179.586 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' HIS . 11.8 t0 -120.0 178.04 4.76 Favored 'General case' 0 C--N 1.279 -2.463 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 1.7 p -134.85 128.52 32.85 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 118.209 0.459 . . . . 0.0 110.07 -175.536 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.552 ' O ' ' HA ' ' A' ' 8' ' ' CYS . 8.3 p -106.9 122.26 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.144 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.2 p -89.41 135.31 33.66 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -177.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.478 ' CE1' HG23 ' A' ' 9' ' ' VAL . 34.1 p90 -146.73 165.61 29.12 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -176.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -95.55 111.05 23.04 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 123.953 0.783 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 131.74 -174.17 20.26 Favored Glycine 0 C--N 1.298 -1.539 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 tt -95.27 -26.87 15.77 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 177.434 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 70' ' ' PRO . 0.3 OUTLIER -143.31 151.76 40.88 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.465 178.699 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.5 tt -125.91 135.06 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.925 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.622 -177.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.4 m -62.17 141.75 58.01 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.383 176.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.557 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 52.1 tp -57.1 -43.22 82.03 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 123.502 0.721 . . . . 0.0 112.404 -175.616 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.532 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 44.4 t -56.45 -45.32 80.87 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.061 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -65.32 -42.06 93.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.376 179.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.61 -46.53 87.85 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 -179.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 31' ' ' LEU . 44.7 mtmt -66.02 -40.43 91.07 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.248 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 32' ' ' CYS . 14.0 mptt -61.89 -39.47 92.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.303 176.439 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -65.34 -50.72 64.54 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.629 177.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 75.7 mt -62.76 -48.29 88.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 123.562 0.539 . . . . 0.0 111.986 -177.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 72.6 mtm -64.72 -37.3 87.12 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.635 -178.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.91 64.14 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.188 -1.006 . . . . 0.0 111.36 177.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -63.51 -45.1 92.2 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.173 0.989 . . . . 0.0 111.658 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HB2' ' CD1' ' A' ' 44' ' ' LEU . 31.7 mt-10 -103.39 3.33 35.01 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.907 -176.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.27 66.13 0.91 Allowed 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 124.614 1.166 . . . . 0.0 111.664 178.052 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' CD1' ' HB2' ' A' ' 42' ' ' GLU . 10.5 mp -98.69 135.09 40.69 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.597 177.553 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HD2' ' HB2' ' A' ' 48' ' ' ASP . 39.4 ttmt -77.79 108.33 10.94 Favored 'General case' 0 N--CA 1.414 -2.247 0 CA-C-O 121.45 0.643 . . . . 0.0 109.951 179.143 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.55 1.67 25.02 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.16 179.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.429 ' H ' ' HG2' ' A' ' 45' ' ' LYS . . . -101.17 -0.88 35.23 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.65 0.738 . . . . 0.0 109.852 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.5 ' HB2' ' HD2' ' A' ' 45' ' ' LYS . 12.2 t70 -115.68 -36.33 4.25 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.001 -1.0 . . . . 0.0 108.412 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 79' ' ' ARG . 17.1 p -143.32 168.68 19.23 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.962 -174.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -116.12 169.38 9.31 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 177.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.531 ' HB3' ' HD2' ' A' ' 35' ' ' LYS . 21.4 tp -120.32 123.01 42.08 Favored 'General case' 0 C--N 1.259 -3.342 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 -178.401 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.576 ' HB2' HG12 ' A' ' 80' ' ' ILE . 41.9 tt0 -115.54 119.21 35.4 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -175.326 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.435 HG13 HG22 ' A' ' 77' ' ' VAL . 1.7 mp -105.87 132.56 52.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 CA-C-O 121.407 0.622 . . . . 0.0 111.032 -176.138 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 34.4 m -113.94 148.63 36.5 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.344 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.534 ' O ' ' HA ' ' A' ' 59' ' ' LYS . 15.1 t-20 -75.35 141.81 43.27 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 175.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.34 -28.33 42.04 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.167 0.508 . . . . 0.0 110.989 -178.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -93.89 -53.33 4.04 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.384 -175.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.4 p -84.95 -22.47 29.19 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -174.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 14.2 mmmm 65.57 23.07 11.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.408 -175.833 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.47 132.18 36.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.226 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -91.15 117.11 29.35 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-O 121.505 0.669 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -86.77 93.72 9.34 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.405 HG22 HE21 ' A' ' 52' ' ' GLN . 19.3 p -92.42 -10.01 39.56 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.492 -177.413 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.784 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 10.5 m-20 -101.73 132.09 47.64 Favored 'General case' 0 CA--C 1.479 -1.769 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.837 176.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -79.46 0.22 30.39 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.269 0.557 . . . . 0.0 111.666 -178.786 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.784 ' ND2' ' HB3' ' A' ' 64' ' ' ASP . 9.7 p30 -90.66 1.8 56.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.797 178.337 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.31 154.47 40.94 Favored 'General case' 0 C--O 1.208 -1.091 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CG ' ' A' ' 28' ' ' HIS . 3.4 pp -118.45 137.39 53.2 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.42 116.68 33.44 Favored Pre-proline 0 C--N 1.302 -1.46 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.396 177.009 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 60.7 Cg_endo -80.15 155.94 22.75 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.294 2.662 . . . . 0.0 113.75 176.559 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 27' ' ' LEU . 13.6 ptmt -58.3 -21.43 49.01 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.825 178.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -87.11 -1.25 57.75 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 120.818 0.342 . . . . 0.0 111.6 -177.617 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.6 m -112.81 149.03 33.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.424 -178.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.4 p -109.39 132.49 54.08 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 16.9 m -132.03 160.76 42.24 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 121.405 0.621 . . . . 0.0 112.556 -177.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.4 mm -108.53 125.57 65.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 179.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 51' ' ' LEU . 43.3 t -104.86 109.72 28.51 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-O 121.517 0.675 . . . . 0.0 109.759 -177.244 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -113.58 129.16 56.61 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.255 -175.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.579 ' HD2' ' SG ' ' A' ' 49' ' ' CYS . 56.5 ttp180 -91.6 129.87 37.5 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -179.213 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.576 HG12 ' HB2' ' A' ' 52' ' ' GLN . 2.6 pp -130.38 153.3 81.28 Favored Pre-proline 0 C--N 1.309 -1.189 0 C-N-CA 121.116 -0.234 . . . . 0.0 110.413 -175.653 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.22 136.77 41.6 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 121.931 1.754 . . . . 0.0 111.122 178.103 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.7 pt -60.78 -31.74 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.915 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -91.52 14.25 64.42 Favored Glycine 0 N--CA 1.439 -1.124 0 C-N-CA 121.078 -0.582 . . . . 0.0 111.993 178.009 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -144.35 65.74 0.45 Allowed Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 178.929 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.415 ' HA ' HD13 ' A' ' 80' ' ' ILE . 40.0 t -81.26 87.18 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.675 0.75 . . . . 0.0 109.983 -177.335 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt . . . . . 0 N--CA 1.425 -1.704 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.354 -179.264 . . . . . . . . 0 0 . 1 stop_ save_