data_1iml_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 1iml _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.042 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.534 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -146.72 134.94 21.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.318 -169.399 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.4 t -84.38 114.94 57.96 Favored Pre-proline 0 C--O 1.25 1.123 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.158 -163.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -59.82 -20.54 59.73 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.787 2.325 . . . . 0.0 113.278 170.191 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -73.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.389 -175.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -93.55 -21.46 19.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.558 -165.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 72.61 57.22 0.13 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.47 -171.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.23 -168.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.99 159.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.534 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.46 152.24 22.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.572 162.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.523 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.9 t -112.09 112.35 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.627 -163.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 17.4 t80 -69.05 153.34 43.94 Favored 'General case' 0 N--CA 1.458 -0.038 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.285 176.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.495 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 2.7 m-85 -60.44 -62.05 2.15 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.835 -159.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.41 10.61 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.644 -173.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -102.55 13.95 33.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.449 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.0 154.72 17.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.228 -161.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.25 151.98 14.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.748 156.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.58 136.48 52.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.616 -169.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.9 t -174.83 131.83 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.185 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.488 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 3.1 mm? 60.04 34.52 21.39 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.558 -170.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.08 18.18 57.0 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 169.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -137.75 154.01 49.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 164.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -88.14 176.9 7.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.367 -166.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -148.96 -177.25 5.7 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.251 -1.341 . . . . 0.0 109.074 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.7 m80 -99.54 143.22 30.03 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.475 169.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.71 -45.15 96.94 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.844 -167.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.3 Cg_endo -64.05 -36.46 48.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.589 2.192 . . . . 0.0 113.669 174.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.48 -46.71 84.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.233 -165.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.3 tp -62.77 83.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.367 -166.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -142.21 149.72 40.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.425 -166.336 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -65.5 127.59 32.46 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.472 175.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 1.2 tt0 -95.97 22.53 7.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.255 -1.338 . . . . 0.0 110.177 171.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 -58.98 2.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.318 169.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.2 p -104.81 -19.94 13.75 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.851 -170.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.89 37.19 34.14 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 176.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -96.1 128.12 42.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.496 -0.352 . . . . 0.0 110.335 167.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.2 m -61.14 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.524 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 57.1 mt -98.08 167.22 11.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.378 -164.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.447 ' CG2' ' N ' ' A' ' 39' ' ' SER . 59.4 m -125.28 173.78 8.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.228 -164.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.447 ' N ' ' CG2' ' A' ' 38' ' ' THR . 1.0 OUTLIER -61.13 91.96 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.48 -178.51 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.53 57.1 8.54 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.22 12.78 3.55 Favored Glycine 0 CA--C 1.524 0.597 0 CA-C-N 114.757 -0.721 . . . . 0.0 111.701 166.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 6.9 p80 -110.86 -168.96 1.37 Allowed 'General case' 0 C--O 1.231 0.084 0 CA-C-N 114.762 -0.719 . . . . 0.0 110.594 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.95 158.52 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.69 165.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.488 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -110.09 124.93 52.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.974 -160.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.523 ' HB3' ' HG3' ' A' ' 48' ' ' LYS . 86.3 t60 -99.53 163.07 12.66 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.121 158.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.423 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 16.4 mp0 -60.31 92.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.241 -160.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.89 45.99 15.09 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.586 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -177.97 104.81 0.21 Allowed Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 121.6 0.714 . . . . 0.0 109.956 169.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -61.77 172.57 3.63 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.603 2.202 . . . . 0.0 113.668 167.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 63.5 m-85 -169.11 177.55 4.8 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.01 -171.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 83.9 m -58.21 140.69 52.57 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.136 -1.393 . . . . 0.0 110.066 160.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.73 -38.94 86.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.191 164.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.509 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 12.3 m-70 -153.21 173.45 4.59 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.342 165.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.476 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.8 Cg_endo -62.59 -18.71 4.6 Favored 'Cis proline' 0 N--CA 1.494 1.504 0 C-N-CA 121.248 -2.397 . . . . 0.0 112.537 -23.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.1 m -57.49 -41.69 81.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.146 -154.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -60.93 -48.02 83.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.412 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.509 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 24.8 t -72.03 -18.07 61.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.437 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.288 -171.053 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo . . . . . 0 N--CA 1.485 1.012 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -151.85 140.82 21.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.386 -167.066 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.51 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.7 t -86.96 116.47 66.17 Favored Pre-proline 0 C--O 1.25 1.108 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.104 -163.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.7 Cg_endo -59.51 -18.08 44.76 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 C-N-CA 122.784 2.322 . . . . 0.0 113.233 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -84.06 -69.44 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.466 -171.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.95 -21.92 18.3 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.638 -168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 t70 72.29 53.33 0.18 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.457 -171.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -111.7 -168.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.981 159.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -105.49 152.33 23.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.724 162.757 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.514 HG23 ' CD2' ' A' ' 24' ' ' HIS . 42.3 t -112.2 111.23 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.633 -163.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -73.65 157.63 36.24 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.287 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.17 -62.32 1.95 Allowed 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -158.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.62 -12.34 61.5 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.723 -173.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.515 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 1.6 mp0 -102.31 44.75 0.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.058 170.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -111.2 150.17 29.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.412 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -140.74 146.34 24.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.528 155.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -115.46 138.35 51.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.748 -166.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -178.19 132.09 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.22 -171.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 44' ' ' GLU . 2.9 mm? 60.05 20.67 9.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.572 -171.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.85 -24.41 21.16 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 170.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.422 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -105.17 154.55 20.05 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 114.87 -0.665 . . . . 0.0 110.137 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.2 176.89 6.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.375 -165.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 24.1 m95 -150.49 -175.14 4.98 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.233 -1.348 . . . . 0.0 108.971 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.4 m80 -100.13 150.27 22.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 113.963 -1.471 . . . . 0.0 110.624 168.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.522 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 22.6 mtp180 -61.32 -56.56 32.76 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.922 -170.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 5.9 Cg_endo -58.77 -36.92 96.33 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.413 2.075 . . . . 0.0 113.567 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.81 -46.36 90.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.285 -164.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 tp -60.02 89.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.236 -160.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -138.4 146.57 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.307 -162.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -66.2 123.64 20.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.446 171.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.467 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -96.72 36.95 1.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.954 168.615 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.84 -44.38 0.88 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.208 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.8 p -116.7 -21.62 8.99 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.006 176.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.94 44.51 11.94 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -105.39 131.06 53.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.422 170.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.2 m -61.0 147.35 43.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.368 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 60.7 mt -110.93 173.99 6.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.331 -168.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.01 -175.61 3.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.381 -167.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.7 t -66.71 -18.94 65.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.376 -167.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.9 62.91 0.08 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 171.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -129.15 12.33 6.08 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.8 p80 -103.87 -168.91 1.56 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.981 -0.609 . . . . 0.0 110.436 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.1 158.61 7.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.966 161.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.525 ' HB2' HD22 ' A' ' 19' ' ' LEU . 4.4 tt0 -115.19 121.31 42.57 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.015 -160.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.451 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -75.0 151.17 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.572 157.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.72 76.37 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.931 -176.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.39 -59.52 0.3 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -163.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HE2' ' HG3' ' A' ' 31' ' ' GLU . 14.0 mtpp -155.32 140.19 12.05 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-O 121.339 0.59 . . . . 0.0 110.052 -160.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.508 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 12.2 Cg_endo -66.04 154.15 75.21 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.958 2.439 . . . . 0.0 113.568 165.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 28.7 m-85 -149.02 -167.24 2.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.84 166.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.6 m -57.7 134.24 56.04 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.287 166.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -68.22 -32.09 72.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.909 159.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 11.9 m-70 -150.96 163.42 23.77 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.338 165.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -68.44 -22.53 8.56 Favored 'Cis proline' 0 N--CA 1.487 1.129 0 C-N-CA 122.427 -1.905 . . . . 0.0 112.798 -18.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 85.6 m -56.99 -43.02 81.32 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.214 -153.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -69.5 -37.8 77.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.471 170.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.516 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 48.1 t -60.77 -17.61 50.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.48 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.187 -167.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.466 0.525 . . . . 0.0 113.466 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -122.23 157.61 31.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.469 -175.006 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -84.92 119.92 73.14 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.246 -161.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -61.55 -25.02 78.93 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.778 2.319 . . . . 0.0 113.236 169.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -75.43 -74.36 0.21 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.421 -176.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -91.67 -22.41 20.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.608 -166.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 72.72 51.92 0.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.575 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.52 -169.01 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.841 158.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -105.3 155.0 19.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.449 160.306 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.523 HG23 ' CD2' ' A' ' 24' ' ' HIS . 47.9 t -112.29 112.13 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.666 -165.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.19 164.34 26.18 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.273 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.35 -62.4 1.9 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 -159.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -12.94 61.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.712 -173.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -101.22 44.55 1.01 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.093 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.54 144.57 40.55 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.483 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.12 119.65 5.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.606 154.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 95.9 m -99.97 141.49 32.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.365 -163.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.507 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.5 t -170.13 133.87 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.275 -163.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.509 HD11 ' N ' ' A' ' 19' ' ' LEU . 6.8 mp 59.87 18.34 7.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.471 161.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.66 -24.2 8.1 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 164.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -140.05 158.17 44.48 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.218 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.466 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.6 m-20 -84.31 178.33 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.301 -165.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 48.9 m95 -147.91 -174.69 4.63 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 113.689 -1.596 . . . . 0.0 109.486 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CD2' HG23 ' A' ' 10' ' ' VAL . 44.6 m80 -99.92 157.81 16.26 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.198 -1.364 . . . . 0.0 110.659 170.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 ttp180 -66.83 -60.03 6.93 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.817 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -60.39 -20.43 63.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.394 2.063 . . . . 0.0 113.723 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -78.56 -54.64 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.19 -169.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' A' ' 37' ' ' LEU . 1.3 tp -65.05 84.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.327 -163.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.58 148.62 52.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 -170.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.6 t -64.76 127.79 33.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.392 172.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -95.8 34.22 1.55 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.049 171.454 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -56.2 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.426 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.5 p -104.67 -17.93 14.48 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.085 -174.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.05 39.88 44.42 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 174.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 3.3 tptt -118.79 138.07 52.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.991 -0.605 . . . . 0.0 110.449 177.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -68.39 159.99 30.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.382 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.5 mt -124.91 123.47 39.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.468 -170.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.62 -168.05 2.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.528 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.9 t -76.01 73.06 2.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.395 -168.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.61 55.36 0.95 Allowed Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 167.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.78 12.77 5.61 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 162.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.6 p80 -114.14 -168.6 1.38 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.24 -177.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.96 157.84 16.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.874 160.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.49 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.7 131.19 55.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.035 -161.102 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.429 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 86.4 t60 -96.44 163.56 13.0 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.371 160.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.429 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 11.5 tp10 -60.79 92.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.108 -162.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 55.25 7.55 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.614 -170.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 176.28 102.98 0.1 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 121.447 0.642 . . . . 0.0 109.876 165.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 18.0 Cg_endo -65.28 149.82 88.03 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.714 2.276 . . . . 0.0 113.627 169.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 50.6 m-85 -143.44 -178.84 6.07 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.007 169.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.5 m -56.23 138.95 49.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 113.49 -1.686 . . . . 0.0 110.802 165.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.7 -31.72 70.99 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.036 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.44 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 27.3 m-70 -161.37 162.38 21.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 CA-C-N 114.715 -1.129 . . . . 0.0 109.251 165.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -73.36 -13.27 19.53 Favored 'Cis proline' 0 N--CA 1.483 0.856 0 C-N-CA 122.65 -1.812 . . . . 0.0 113.609 -13.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 80.7 m -59.5 -42.01 91.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.72 -156.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -66.44 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.306 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -60.64 -11.64 7.88 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.42 -169.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.352 176.306 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo . . . . . 0 N--CA 1.485 1.025 0 N-CA-C 113.612 0.581 . . . . 0.0 113.612 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -142.28 151.16 41.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.5 172.07 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.9 t -88.01 117.74 68.8 Favored Pre-proline 0 C--O 1.251 1.155 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.253 -162.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -59.72 -22.1 66.09 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.732 2.288 . . . . 0.0 113.171 169.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -74.09 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.441 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.61 -21.26 19.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.61 -164.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.43 58.58 0.13 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.452 -170.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.15 -168.56 1.54 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.01 160.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.8 mt-10 -105.76 152.57 23.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.63 161.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.8 t -112.44 113.09 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.595 -162.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -72.84 156.27 39.06 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.371 177.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -60.35 -62.3 1.97 Allowed 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.839 -159.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -1.4 10.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.736 -173.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -102.57 14.46 31.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.422 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.96 152.86 18.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.306 -161.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.7 m -145.5 153.56 13.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.65 156.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.33 142.69 35.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.767 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.46 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 38.7 t -177.46 133.35 0.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.284 172.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.462 ' HB3' ' NZ ' ' A' ' 21' ' ' LYS . 3.3 mm? 59.96 32.21 21.03 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.537 -172.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.86 18.34 68.43 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 167.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' NZ ' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -140.4 155.11 46.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 165.339 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.6 176.99 7.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.305 -164.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 29.2 m95 -149.27 -175.49 5.0 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.196 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 43.3 m80 -100.6 140.61 34.62 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.527 169.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.528 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 17.3 tpt85 -62.02 -46.52 91.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 115.206 -0.907 . . . . 0.0 109.871 -173.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.0 Cg_exo -50.01 -39.62 50.17 Favored 'Trans proline' 0 N--CA 1.484 0.967 0 C-N-CA 122.724 2.283 . . . . 0.0 113.418 169.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.81 -47.62 37.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.268 -164.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.47 HD21 HG23 ' A' ' 16' ' ' VAL . 4.1 tp -66.16 77.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.488 -170.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' HE3' ' HB2' ' A' ' 29' ' ' LYS . 15.5 ptmt -138.31 141.42 39.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.393 -171.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.5 t -60.26 122.01 13.43 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 172.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 20.0 mt-10 -96.88 38.59 1.22 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.166 167.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -39.1 0.76 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.382 -177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.8 p -120.6 -27.57 5.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.056 172.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.29 47.15 5.58 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.534 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -104.25 130.58 52.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.416 167.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.463 HG21 ' N ' ' A' ' 37' ' ' LEU . 85.9 m -64.39 146.83 53.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.373 167.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.0 mt -114.89 131.03 56.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.401 -167.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -78.98 -167.86 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.482 168.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -65.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.453 -168.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -127.49 56.9 0.72 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.72 10.3 3.7 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 114.997 -0.602 . . . . 0.0 111.89 166.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.522 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 27.2 p80 -108.75 -170.16 1.62 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 111.026 -175.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.408 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -146.57 -163.21 1.7 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.845 168.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.517 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -171.12 132.83 0.84 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.302 174.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -95.24 159.3 15.08 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 154.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.68 90.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.018 -161.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.87 -44.09 1.21 Allowed Glycine 0 CA--C 1.53 1.004 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.733 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 7.2 mtmm -132.28 108.53 13.63 Favored Pre-proline 0 C--O 1.243 0.74 0 CA-C-O 121.139 0.495 . . . . 0.0 109.81 -159.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 16.1 Cg_endo -67.75 155.87 68.22 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 123.115 2.543 . . . . 0.0 113.648 165.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.3 m-85 -152.62 -162.16 1.44 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.858 169.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.3 m -57.45 139.09 54.16 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.316 162.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.408 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 55.7 t30 -60.61 -34.67 74.56 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.103 164.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.1 m-70 -158.56 173.1 5.31 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.386 164.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.515 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.1 Cg_endo -63.23 -18.95 5.13 Favored 'Cis proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.466 -2.306 . . . . 0.0 112.603 -22.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.4 m -57.33 -40.36 77.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.219 -154.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -60.93 -48.31 82.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.309 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -65.52 -18.31 65.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.644 177.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.504 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.126 -165.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.545 0.556 . . . . 0.0 113.545 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HG2' ' N ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -119.39 142.87 47.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.339 -169.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.9 t -78.72 118.68 73.81 Favored Pre-proline 0 C--O 1.252 1.207 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.47 -162.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -61.8 -12.0 23.43 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 123.011 2.474 . . . . 0.0 113.479 170.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.536 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 ttpp -93.52 -77.08 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.58 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.8 p -88.5 -19.47 26.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.985 -163.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.72 56.16 0.18 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.497 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.05 -172.57 2.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.013 161.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -97.55 152.78 18.67 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.68 166.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG23 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -116.34 111.71 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.549 -163.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.7 158.56 31.99 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.367 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.429 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 1.1 t80 -60.36 -65.86 0.62 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.803 -159.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -12.51 61.62 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.701 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.97 46.72 0.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.95 168.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 12.7 ptt85 -118.56 149.91 40.55 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.77 170.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.432 HG21 ' HB2' ' A' ' 23' ' ' TRP . 19.3 m -138.62 149.25 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.554 157.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -114.06 136.99 52.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.475 -163.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 24.3 t -178.23 135.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.393 -170.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 59.98 17.91 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.717 -176.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.36 -24.89 30.38 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 166.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.98 164.9 13.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.843 -0.679 . . . . 0.0 110.07 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -90.8 177.44 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.283 -165.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.0 m95 -153.03 173.72 15.07 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 113.907 -1.497 . . . . 0.0 108.99 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 44.7 m80 -92.08 142.65 27.28 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.466 174.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.18 -49.87 86.49 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.793 -172.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.6 Cg_endo -58.29 -41.02 70.66 Favored 'Trans proline' 0 N--CA 1.484 0.915 0 C-N-CA 122.551 2.168 . . . . 0.0 113.613 172.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.536 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.5 m -61.1 -48.13 83.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.213 -171.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD13 ' CE1' ' A' ' 42' ' ' HIS . 4.2 tp -67.71 94.3 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.379 -167.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' N ' HD13 ' A' ' 37' ' ' LEU . 6.7 ttmt -153.16 149.46 28.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.471 -171.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -73.24 122.72 22.39 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.372 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -97.78 42.03 1.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.042 167.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 13.3 tptp -132.3 -49.87 0.93 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.328 172.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -109.26 -31.35 7.6 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.763 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.17 49.16 5.39 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -104.04 132.47 50.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.405 -0.397 . . . . 0.0 110.346 161.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 m -60.56 136.97 58.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.345 166.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 39.8 mt -97.89 169.66 9.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.315 -163.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.5 -174.97 2.66 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.355 -161.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -72.83 67.89 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.316 165.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.94 53.62 2.81 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 172.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.39 12.24 8.45 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 160.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.525 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.5 p80 -110.62 -169.61 1.49 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 114.911 -0.644 . . . . 0.0 110.469 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.55 -163.28 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.72 165.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -155.32 139.29 16.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.189 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.485 ' CD2' ' HG2' ' A' ' 46' ' ' GLU . 41.2 t60 -124.59 104.32 8.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.058 172.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.485 ' HG2' ' CD2' ' A' ' 45' ' ' HIS . 6.5 mm-40 58.59 43.35 19.23 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.799 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.84 -20.16 50.37 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 168.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.71 99.73 14.36 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.412 0.625 . . . . 0.0 109.867 -167.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.532 ' HD2' ' HD2' ' A' ' 5' ' ' LYS . 9.7 Cg_endo -66.1 153.9 76.25 Favored 'Trans proline' 0 N--CA 1.484 0.948 0 C-N-CA 122.429 2.086 . . . . 0.0 113.602 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 38.3 m-85 -151.46 -165.75 2.33 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.04 167.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.6 m -57.61 132.26 52.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.99 -1.459 . . . . 0.0 110.395 165.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.86 -36.27 78.74 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.917 162.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.498 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 22.5 m-70 -152.8 168.49 11.32 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.134 161.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 20.1 Cg_endo -67.57 -22.79 7.88 Favored 'Cis proline' 0 N--CA 1.489 1.232 0 C-N-CA 122.43 -1.904 . . . . 0.0 112.838 -17.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.4 m -56.96 -41.2 77.9 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.286 -153.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.39 -61.39 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.368 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.498 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -92.38 23.96 3.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.516 -166.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.354 172.345 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.487 1.12 0 N-CA-C 113.5 0.539 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -130.72 139.48 50.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.378 172.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 28.7 t -82.92 122.84 78.19 Favored Pre-proline 0 C--O 1.25 1.097 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.178 -162.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -62.63 -30.97 79.54 Favored 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.99 2.46 . . . . 0.0 113.23 169.015 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -71.08 0.23 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.394 -176.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.9 -22.75 16.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.601 -164.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 72.4 68.37 0.13 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.456 -168.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 -168.23 1.91 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.208 162.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.69 151.41 23.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.341 164.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.51 HG21 ' NE2' ' A' ' 24' ' ' HIS . 62.9 t -120.41 111.25 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.846 -162.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.0 163.6 25.74 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.431 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.57 -59.44 5.4 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.887 -160.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.641 -176.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.03 37.87 2.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.058 166.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.441 ' HA ' ' CG1' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -118.69 131.84 56.15 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.943 163.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 19.9 m -112.04 167.62 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.508 156.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 m -126.58 138.03 53.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.546 -167.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.451 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 35.6 t -177.42 137.5 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.395 -177.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.475 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 60.01 17.94 7.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.689 -177.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.13 -24.95 29.48 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.569 -1.013 . . . . 0.0 110.569 166.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.0 160.84 19.11 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 114.883 -0.658 . . . . 0.0 110.129 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -88.42 177.03 6.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.271 -165.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.515 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -150.15 163.14 38.98 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.067 -1.424 . . . . 0.0 109.362 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.7 m80 -82.88 138.45 33.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.347 170.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.439 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.91 -46.69 96.81 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.779 -169.083 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_exo -54.59 -43.8 55.59 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 122.697 2.265 . . . . 0.0 113.537 169.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.83 -49.81 74.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.306 -169.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.16 88.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.376 -168.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.435 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.3 142.47 27.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.333 -169.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -60.12 122.13 13.65 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.466 171.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 27.1 mt-10 -96.32 38.23 1.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.964 165.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.79 -50.84 1.24 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.046 175.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.9 p -112.08 -20.42 11.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.874 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.8 44.4 20.03 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -100.58 127.18 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.335 169.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 72.0 m -61.44 139.8 58.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.412 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 77.9 mt -104.32 116.55 32.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.292 -169.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -118.57 -171.23 2.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.531 -172.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 t 57.83 -90.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.098 163.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.36 43.15 0.07 OUTLIER Glycine 0 CA--C 1.533 1.18 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 161.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.7 24.24 15.62 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -167.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 7.7 p80 -101.16 -169.41 1.69 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.597 -0.802 . . . . 0.0 110.52 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.38 158.32 7.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.816 162.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp20? -115.05 133.65 55.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.025 -159.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.416 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 69.2 t60 -102.7 162.64 12.76 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 157.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.416 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 3.9 mm-40 -60.67 90.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.169 -161.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.77 -19.08 12.56 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.757 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -141.1 105.37 6.13 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-O 121.254 0.55 . . . . 0.0 109.773 -162.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.537 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.6 Cg_endo -66.43 161.08 42.54 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.872 2.381 . . . . 0.0 113.62 165.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 81.1 m-85 -159.14 -171.18 3.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.0 173.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.5 m -58.08 139.54 54.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 113.666 -1.606 . . . . 0.0 110.321 165.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -60.36 -35.44 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.261 164.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 11.5 m-70 -156.35 171.3 7.54 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.378 167.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -62.65 -18.11 4.64 Favored 'Cis proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.135 -2.444 . . . . 0.0 112.539 -24.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.2 m -57.61 -41.74 81.86 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.129 -154.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -61.06 -60.02 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.294 174.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.448 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -70.97 -11.4 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.433 -168.577 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.372 177.061 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.484 0.97 0 N-CA-C 113.571 0.566 . . . . 0.0 113.571 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -123.88 146.98 48.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.466 -169.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.2 t -83.41 117.0 67.36 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.275 -165.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.63 -22.08 73.57 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.786 2.324 . . . . 0.0 113.238 169.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.44 -73.57 0.27 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.451 -175.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -92.11 -22.54 19.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.526 -167.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t0 72.99 60.48 0.1 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.555 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.45 -169.23 1.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.068 159.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.76 153.1 18.49 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.477 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.524 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.7 t -112.71 112.98 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.573 -167.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -69.0 152.69 44.93 Favored 'General case' 0 C--N 1.335 -0.065 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.212 175.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -59.97 4.55 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.712 -158.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.86 -0.29 10.92 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.581 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.42 15.49 28.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.336 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -96.89 153.41 17.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.248 -161.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.501 HG22 HD21 ' A' ' 28' ' ' LEU . 18.0 m -146.2 149.16 16.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.692 157.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.72 136.82 48.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.753 -169.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.448 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.45 138.77 0.23 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.31 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.468 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 59.98 23.95 13.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.663 -176.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.16 -24.78 28.6 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 166.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -115.43 163.5 15.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.793 -0.704 . . . . 0.0 110.247 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.73 176.02 7.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.418 -168.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 32.2 m95 -147.28 -177.54 5.74 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.115 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' NE2' HG21 ' A' ' 10' ' ' VAL . 42.6 m80 -102.42 141.06 35.85 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.521 169.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.54 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 11.5 mtm180 -60.88 -50.84 83.21 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.896 -171.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.54 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 7.0 Cg_exo -50.54 -36.83 50.86 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.386 2.057 . . . . 0.0 113.521 171.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.34 -52.28 23.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.372 -168.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.508 HD13 ' CE1' ' A' ' 42' ' ' HIS . 3.9 tp -64.4 92.23 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.374 -167.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 pttp -150.15 147.97 28.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.455 -170.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -64.65 121.42 14.44 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.29 171.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -95.36 44.91 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.033 163.562 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -137.18 -45.26 0.56 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.352 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.6 p -115.62 -33.53 5.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.924 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.67 50.15 5.11 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.72 129.1 55.92 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.248 158.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.8 m -61.3 136.95 58.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.286 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 14.9 mt -92.09 134.61 34.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.351 -161.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.411 HG21 ' N ' ' A' ' 39' ' ' SER . 80.2 m -97.37 146.36 25.25 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.937 175.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.411 ' N ' HG21 ' A' ' 38' ' ' THR . 28.3 m 61.24 -156.14 0.35 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.952 159.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -89.99 54.92 3.67 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 156.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -105.45 14.08 47.12 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.8 p80 -113.1 -167.39 1.18 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-N 113.927 -1.137 . . . . 0.0 110.469 173.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.89 159.87 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.301 160.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.468 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -126.1 122.65 36.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.069 -165.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -92.65 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.935 161.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.46 42.25 21.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.832 170.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 23.59 61.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -119.54 84.78 30.72 Favored Pre-proline 0 CA--C 1.541 0.621 0 CA-C-O 121.547 0.689 . . . . 0.0 109.825 176.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -63.61 148.74 92.15 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.511 2.141 . . . . 0.0 113.761 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 52.2 m-85 -154.49 -167.37 2.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.971 171.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.1 m -57.12 133.44 55.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 113.496 -1.684 . . . . 0.0 110.499 163.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -25.5 66.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.003 162.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 20.0 m-70 -166.63 162.69 11.41 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.356 169.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -71.28 -13.83 15.24 Favored 'Cis proline' 0 N--CA 1.482 0.831 0 C-N-CA 122.5 -1.875 . . . . 0.0 113.509 -15.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.0 m -59.7 -43.41 94.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.65 -156.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -60.9 -54.43 45.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.494 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -77.72 -16.01 58.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.358 -167.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.258 -177.821 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo . . . . . 0 N--CA 1.486 1.034 0 N-CA-C 113.615 0.583 . . . . 0.0 113.615 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -122.95 160.03 27.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.416 -167.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -85.92 121.11 73.07 Favored Pre-proline 0 C--O 1.251 1.148 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.096 -164.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -61.25 -28.9 85.52 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 C-N-CA 122.724 2.283 . . . . 0.0 113.163 169.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -70.07 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.426 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.45 -22.13 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.619 -166.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 72.59 54.45 0.15 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.475 -171.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -168.71 1.36 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 159.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -106.46 152.88 23.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.583 161.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 41.7 t -112.7 112.32 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.54 -162.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -75.54 159.76 30.91 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.361 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -60.45 -62.42 1.87 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.778 -159.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.58 11.11 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.688 -173.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -101.99 13.75 33.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.505 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -97.04 151.07 20.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.36 -160.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.463 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.37 156.2 15.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.736 156.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.93 137.13 52.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.667 -169.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.441 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 42.4 t -174.14 136.82 0.52 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.271 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 59.99 18.75 7.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.618 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.58 28.37 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.39 155.24 19.31 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 114.89 -0.655 . . . . 0.0 110.184 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.5 177.19 6.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.323 -166.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 26.6 m95 -149.17 -175.74 5.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.153 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 44.0 m80 -98.67 145.55 26.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.463 168.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.74 -44.86 96.46 Favored Pre-proline 0 CA--C 1.545 0.774 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.838 -166.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -64.71 -35.58 45.65 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.532 2.155 . . . . 0.0 113.547 173.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.22 -44.35 84.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.339 -163.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.73 82.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.354 -174.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 10.7 ttmt -148.58 144.88 27.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.14 -0.937 . . . . 0.0 110.331 -162.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -65.02 126.17 27.2 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.536 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -96.88 27.37 4.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.065 166.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.44 -35.78 2.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.279 -175.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -126.09 -25.98 3.47 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.062 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.58 49.47 6.62 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -175.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.03 124.2 45.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.317 164.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.533 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 95.4 m -61.18 135.09 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.164 167.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 93.4 mt -100.58 139.47 36.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.392 -164.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 73.5 m -60.62 154.35 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.184 163.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.6 t -66.29 62.69 0.04 OUTLIER 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.486 160.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 146.95 144.74 4.08 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.371 -162.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.91 13.53 83.55 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 119.853 -1.165 . . . . 0.0 111.483 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -112.22 -170.0 1.58 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 114.667 -0.767 . . . . 0.0 110.813 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.509 ' HB2' ' CD2' ' A' ' 56' ' ' TYR . . . -152.04 -162.77 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.604 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.5 tt0 -170.02 138.1 1.68 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.183 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -96.49 173.03 7.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.775 157.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 89.01 0.21 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.083 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.07 -65.95 0.33 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -168.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -152.61 144.78 16.79 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-O 121.521 0.677 . . . . 0.0 109.96 -162.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.4 Cg_endo -72.73 171.26 17.65 Favored 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.834 2.356 . . . . 0.0 113.62 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 29.5 m-85 -155.94 -164.55 1.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.241 165.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.4 m -57.91 135.68 56.93 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.258 162.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -60.85 -34.52 74.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.054 162.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 25.3 m-70 -157.6 164.25 22.11 Favored Pre-proline 0 CA--C 1.552 1.03 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.335 166.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.423 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.47 -15.69 16.93 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.584 -1.84 . . . . 0.0 113.534 -14.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.0 m -59.57 -41.91 91.28 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.826 -156.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.509 ' CD2' ' HB2' ' A' ' 43' ' ' ALA . 9.6 t80 -61.18 -56.94 14.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.452 172.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.7 t -62.99 -20.51 65.35 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.372 -171.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.184 -166.143 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.64 0.592 . . . . 0.0 113.64 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 147.36 41.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.405 -170.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.6 t -85.64 118.94 71.57 Favored Pre-proline 0 C--O 1.25 1.13 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.178 -164.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.514 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 3.0 Cg_endo -59.49 -27.51 85.14 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 122.518 2.145 . . . . 0.0 113.131 169.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -72.63 -70.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.448 -174.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -96.78 -21.92 17.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.626 -165.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 72.33 53.18 0.17 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.544 -173.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -112.72 -169.06 1.41 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.944 159.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -101.98 151.01 22.63 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.596 163.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 46.8 t -110.55 110.69 33.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.616 -167.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.43 161.67 29.03 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.385 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -60.15 -62.3 1.97 Allowed 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -158.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.14 60.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.731 -175.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -104.39 49.26 0.82 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.861 167.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 143.13 45.85 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.504 -1.225 . . . . 0.0 110.601 170.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 m -132.5 117.93 33.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.442 152.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.1 m -97.75 142.43 29.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.402 -173.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.1 t -177.72 137.27 0.2 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.089 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.514 HD11 ' N ' ' A' ' 19' ' ' LEU . 4.6 mp 60.27 16.88 6.52 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.431 -1.258 . . . . 0.0 110.603 -172.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.99 -25.63 24.74 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 164.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -117.17 149.67 39.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.807 -0.696 . . . . 0.0 110.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -85.7 177.69 7.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.193 -165.298 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.514 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 31.2 m95 -151.49 -176.59 5.65 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.483 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 10' ' ' VAL . 44.2 m80 -97.71 150.21 21.45 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.59 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.536 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.7 ttt180 -61.3 -48.87 90.14 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.83 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 3.9 Cg_exo -66.85 -26.27 44.75 Favored 'Trans proline' 0 N--CA 1.484 0.931 0 C-N-CA 122.502 2.134 . . . . 0.0 113.569 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.55 -51.97 10.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.228 -164.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.449 HD11 ' CD2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -61.92 91.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.403 -160.844 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.52 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 mtpp -145.76 153.39 40.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.327 -172.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -65.23 122.42 17.07 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.242 163.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.423 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -96.0 28.53 3.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.117 169.121 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -50.42 2.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.074 177.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.9 p -112.26 -20.25 11.93 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.916 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.46 40.12 20.01 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 126.36 41.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.435 -0.383 . . . . 0.0 110.326 167.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.4 m -61.08 137.21 58.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.27 168.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.54 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 46.1 mt -99.64 161.24 13.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -164.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.73 -163.53 1.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.229 -166.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.49 20.86 6.78 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.471 -177.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.22 55.34 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.34 12.77 4.34 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 170.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 12.6 p80 -106.73 -168.94 1.48 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.707 -0.747 . . . . 0.0 110.745 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -150.61 -169.97 3.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.991 165.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.21 141.24 48.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.124 170.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -139.92 101.54 4.2 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.846 175.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 58.62 46.42 14.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.627 -169.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 63.54 19.36 62.4 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.611 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.92 98.5 42.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 121.199 0.523 . . . . 0.0 109.73 169.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.509 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 11.3 Cg_endo -54.94 141.37 78.42 Favored 'Trans proline' 0 N--CA 1.487 1.088 0 C-N-CA 122.055 1.837 . . . . 0.0 113.446 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 97.5 m-85 -150.49 -179.23 7.05 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.106 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.8 m -56.72 131.16 48.34 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.472 165.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.97 -33.64 73.52 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.886 161.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.6 m-70 -155.94 164.83 20.01 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.258 163.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.465 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.8 Cg_endo -73.06 -16.82 17.48 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.696 -1.793 . . . . 0.0 113.616 -13.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.7 m -59.59 -43.92 93.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.778 -156.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -61.11 -55.34 33.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.316 177.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 29.6 t -80.94 -16.79 52.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.469 -165.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.309 -178.139 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 N--CA 1.484 0.931 0 N-CA-C 113.568 0.564 . . . . 0.0 113.568 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.6 OUTLIER -138.17 139.95 39.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.443 170.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.1 t -86.07 115.64 62.68 Favored Pre-proline 0 C--O 1.25 1.114 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.258 -164.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -60.05 -16.79 41.34 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 C-N-CA 122.771 2.314 . . . . 0.0 113.313 170.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -69.21 0.67 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.52 -171.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -94.21 -21.44 19.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.608 -170.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.34 52.1 0.18 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.496 -171.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.06 -168.49 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.856 160.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 4.2 mt-10 -106.51 152.08 24.15 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.606 161.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -111.65 111.85 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.653 -164.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.538 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 6.2 t80 -75.46 157.84 33.47 Favored 'General case' 0 N--CA 1.458 -0.054 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.311 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -59.78 -62.1 2.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 -157.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.55 -11.32 60.86 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.671 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.538 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.2 pt-20 -102.73 42.97 1.1 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.17 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.89 149.87 29.25 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.454 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.468 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.3 m -141.44 148.63 20.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.627 155.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.55 137.61 50.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.657 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.433 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 15.8 t -176.33 128.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.336 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.439 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 2.2 mm? 59.93 35.37 21.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.605 -170.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.82 18.04 52.13 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HG2' ' N ' ' A' ' 22' ' ' ASP . 20.7 ttmt -137.11 153.61 50.48 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 164.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.515 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 m-20 -88.68 177.08 6.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.392 -165.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.4 m95 -151.15 -173.25 4.44 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.954 -177.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.7 m80 -102.94 146.03 28.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 113.894 -1.503 . . . . 0.0 110.54 169.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.517 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.6 OUTLIER -60.91 -50.13 86.23 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.862 -169.204 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 6.5 Cg_exo -62.42 -34.8 75.44 Favored 'Trans proline' 0 N--CA 1.484 0.933 0 C-N-CA 122.549 2.166 . . . . 0.0 113.49 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.77 -52.9 58.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.232 -167.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.42 93.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.253 -164.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.535 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.1 mttp -148.15 139.1 23.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.356 -164.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.2 t -65.66 120.81 13.63 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.354 166.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.507 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 5.7 pt-20 -98.69 39.74 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.755 167.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.477 ' HD2' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -132.18 -39.32 1.06 Allowed 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.288 179.238 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -119.89 -22.2 6.87 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.12 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.99 41.44 12.32 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -95.19 122.55 37.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.49 -0.355 . . . . 0.0 110.372 167.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 90.8 m -61.09 135.62 57.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.317 170.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 87.1 mt -101.7 97.83 8.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.314 -167.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.4 t -60.05 -160.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.352 161.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -68.94 0.2 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.611 170.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.91 -161.99 9.8 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 154.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.53 69.16 0.36 Allowed Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 165.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -90.77 -170.83 2.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.912 -0.644 . . . . 0.0 110.951 169.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -165.28 -168.9 1.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.196 172.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.9 pp20? -152.88 139.7 19.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.057 -169.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -137.25 106.61 6.08 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.856 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.38 33.19 22.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.906 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.46 -27.57 10.48 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 166.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 103.01 20.55 Favored Pre-proline 0 C--O 1.244 0.771 0 CA-C-O 121.328 0.585 . . . . 0.0 109.845 -170.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.519 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.7 Cg_endo -63.75 147.81 92.33 Favored 'Trans proline' 0 N--CA 1.484 0.923 0 C-N-CA 122.485 2.123 . . . . 0.0 113.669 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 4.3 m-85 -139.89 -165.27 1.86 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.78 164.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.9 m -57.56 135.11 56.63 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.099 159.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -62.81 -33.0 74.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.927 161.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.443 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 21.6 m-70 -157.29 162.41 27.5 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.408 169.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -71.54 -14.9 15.59 Favored 'Cis proline' 0 N--CA 1.482 0.826 0 C-N-CA 122.548 -1.855 . . . . 0.0 113.477 -14.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.3 m -59.84 -45.95 90.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.691 -156.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -60.84 -53.61 55.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.454 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.443 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.5 p -66.96 -28.71 68.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.334 -170.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.302 -169.53 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . 0.53 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 2.4 Cg_endo . . . . . 0 N--CA 1.487 1.106 0 N-CA-C 113.457 0.522 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.23 139.0 52.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.471 170.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.4 t -85.77 116.63 66.42 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.144 -165.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -60.33 -23.55 74.86 Favored 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 122.723 2.282 . . . . 0.0 113.283 169.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -70.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.466 -174.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -94.91 -22.08 18.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.658 -167.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.48 57.58 0.14 Allowed 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.521 -171.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -117.19 -168.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.919 160.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -104.42 153.61 20.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.688 162.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.523 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.8 t -113.04 114.21 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.537 -163.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -71.99 156.38 39.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.396 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -60.51 -62.26 1.99 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.837 -159.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.37 -1.17 9.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.688 -173.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.82 14.81 31.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.432 178.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.31 152.05 19.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.286 -161.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.47 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.73 150.12 16.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.646 155.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 m -113.58 135.14 54.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.803 -168.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.7 t -177.69 139.62 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.422 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 60.09 30.24 19.73 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.629 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.42 18.49 79.38 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 166.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -152.79 164.7 37.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.448 -0.376 . . . . 0.0 110.163 166.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 3.8 m-20 -90.65 176.79 6.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.392 -166.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.9 m95 -147.45 -176.71 5.35 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.166 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' NE2' HG21 ' A' ' 10' ' ' VAL . 44.3 m80 -101.36 142.62 32.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.499 168.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.52 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.72 -45.37 96.95 Favored Pre-proline 0 CA--C 1.543 0.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.819 -168.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 6.6 Cg_endo -62.96 -34.03 72.56 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.513 2.142 . . . . 0.0 113.647 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -67.48 -56.02 11.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.279 -166.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.484 HD11 ' CD2' ' A' ' 23' ' ' TRP . 1.1 tp -60.59 89.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.391 -164.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.525 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.54 146.32 29.4 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.418 -174.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.3 t -60.12 124.71 21.09 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.354 170.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -96.34 20.1 10.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.133 169.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -105.32 -60.24 1.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.317 166.366 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.6 p -105.81 -21.54 13.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.825 -168.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.5 39.85 20.72 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.38 121.41 37.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.903 0.382 . . . . 0.0 110.194 166.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.99 132.51 54.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.288 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.525 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 60.7 mt -96.8 123.2 40.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.314 -168.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -60.11 -162.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.544 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -95.65 32.49 1.81 Allowed 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.522 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -168.0 143.83 8.45 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -170.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.85 13.84 83.2 Favored Glycine 0 N--CA 1.468 0.787 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.284 163.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -106.1 -168.72 1.47 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.581 -0.81 . . . . 0.0 110.713 169.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.53 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -157.67 -177.4 6.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.244 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -168.8 124.6 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.881 -166.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -155.39 121.46 5.14 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.694 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.47 39.51 25.0 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.796 -176.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 -21.39 37.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm -98.18 102.81 15.05 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 121.826 0.822 . . . . 0.0 109.845 -168.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 13.5 Cg_endo -59.34 147.87 89.08 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.022 1.814 . . . . 0.0 113.372 168.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 9.8 m-85 -154.92 -166.75 2.39 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.241 169.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.2 m -57.63 135.37 56.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.372 163.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.53 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 13.3 t-20 -60.62 -30.92 70.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.144 162.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.517 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 30.5 m-70 -162.63 164.9 16.06 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.369 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.404 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -71.68 -14.34 15.9 Favored 'Cis proline' 0 N--CA 1.482 0.82 0 C-N-CA 122.517 -1.868 . . . . 0.0 113.586 -14.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.1 m -59.85 -42.3 93.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -156.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.09 -39.58 90.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.376 176.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.517 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 24.7 p -76.12 -18.09 59.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.206 -168.364 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -134.67 156.7 48.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.424 170.835 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.8 t -81.39 119.26 75.21 Favored Pre-proline 0 C--O 1.25 1.111 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.346 -161.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.19 -19.03 61.85 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 C-N-CA 122.878 2.385 . . . . 0.0 113.233 167.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.67 -77.26 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.47 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -91.5 -19.56 22.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.903 -164.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.23 55.03 0.17 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.495 -173.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -114.74 -168.64 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.995 160.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 7.7 mt-10 -104.77 153.24 21.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.546 161.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 39.1 t -113.21 113.27 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.492 -163.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.38 157.15 37.48 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.42 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.39 -62.38 1.9 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 -159.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.54 -1.07 9.85 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.553 -173.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -102.81 14.21 32.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.442 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.52 152.52 18.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.266 -161.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.467 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.04 147.67 18.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.578 155.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.51 137.06 52.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.675 -168.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.436 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 10.5 t -178.08 130.01 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.297 -171.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 1.9 mm? 60.14 28.51 18.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.538 -171.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.01 18.05 70.38 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -138.68 155.1 48.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 164.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.9 177.03 6.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.375 -165.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 25.3 m95 -150.56 -176.74 5.61 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.102 -177.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 43.2 m80 -100.57 142.38 32.11 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.448 169.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.447 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 5.8 mtm180 -61.08 -46.31 96.24 Favored Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.781 -170.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 7.9 Cg_exo -60.84 -36.1 85.45 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.608 2.205 . . . . 0.0 113.535 174.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.44 -46.89 74.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.343 -168.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.449 HD21 HG22 ' A' ' 16' ' ' VAL . 7.6 tp -62.88 93.07 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.441 -166.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -149.31 142.48 25.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -60.01 124.42 20.15 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.551 174.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.35 23.88 5.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.215 171.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -59.52 2.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.378 168.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.4 p -104.0 -16.15 15.4 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.863 -169.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 48.97 58.02 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -171.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -104.57 115.23 29.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.453 -0.373 . . . . 0.0 110.323 167.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.9 m -61.26 134.94 57.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.493 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 75.8 mt -97.46 125.81 42.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.425 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -71.6 -162.45 0.08 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.481 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.21 -15.29 32.78 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.605 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -159.25 -179.62 34.21 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -169.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.82 15.42 81.33 Favored Glycine 0 C--N 1.342 0.872 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.337 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.469 ' HB2' HD11 ' A' ' 37' ' ' LEU . 7.0 p80 -109.71 -168.47 1.33 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 114.521 -0.84 . . . . 0.0 110.579 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.12 -169.11 2.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.332 170.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.441 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -150.77 131.69 14.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.989 -168.388 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 39.9 t60 -135.62 100.45 4.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.994 176.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 58.6 43.89 18.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.832 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.09 -21.53 44.68 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -97.89 100.94 9.48 Favored Pre-proline 0 C--O 1.242 0.686 0 CA-C-O 121.283 0.563 . . . . 0.0 109.807 -172.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -62.31 164.99 16.03 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.378 2.052 . . . . 0.0 113.737 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 71.9 m-85 -161.99 176.61 10.59 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.073 -171.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.8 m -57.86 128.41 36.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.961 -1.472 . . . . 0.0 110.054 160.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -60.86 -32.93 72.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.912 162.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 -154.26 161.4 29.38 Favored Pre-proline 0 CA--C 1.551 1.018 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.154 163.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -74.39 -18.25 18.21 Favored 'Cis proline' 0 C--N 1.354 0.835 0 C-N-CA 122.718 -1.784 . . . . 0.0 113.61 -12.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -58.92 -45.34 90.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.89 -154.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -61.05 -61.89 2.25 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.0 p -72.68 -11.91 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.444 -173.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.374 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.068 179.182 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.487 1.092 0 N-CA-C 113.542 0.555 . . . . 0.0 113.542 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 6.4 pttp -126.12 156.21 40.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.36 -168.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -85.28 116.97 67.76 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.126 -163.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.511 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_endo -60.16 -21.85 67.74 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.584 2.189 . . . . 0.0 113.108 169.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -72.47 0.38 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.484 -173.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.6 p -91.84 -21.16 20.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.598 -169.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.02 52.29 0.13 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.597 -171.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -108.61 -169.33 1.48 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.884 158.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.525 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -106.76 151.72 24.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.531 160.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.52 HG21 ' NE2' ' A' ' 24' ' ' HIS . 54.7 t -112.68 124.91 69.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.711 -166.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.482 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 13.1 p90 -101.29 160.31 14.52 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.488 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HA ' ' HB3' ' A' ' 15' ' ' ARG . 7.0 p90 -59.61 -40.96 89.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.89 -158.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.06 -0.09 38.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.161 -163.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.482 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 0.7 OUTLIER -113.37 9.74 18.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.686 166.203 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.476 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -80.66 141.15 35.22 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.36 -159.116 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.2 m -146.82 125.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.024 160.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -98.79 142.03 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.434 -168.556 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.512 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.6 138.65 0.22 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.566 -168.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 59.92 32.49 21.21 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.726 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.41 -24.09 21.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 168.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.409 ' CE ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.35 -174.01 2.52 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 114.864 -0.668 . . . . 0.0 110.022 177.089 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.533 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.2 m-20 -106.4 177.05 4.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.309 -173.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.512 ' NE1' ' HB3' ' A' ' 18' ' ' SER . 37.4 m95 -149.71 -172.29 4.11 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.267 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.52 ' NE2' HG21 ' A' ' 10' ' ' VAL . 42.5 m80 -101.65 159.44 15.31 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.558 170.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.404 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -74.3 -57.05 2.31 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.717 -175.522 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 4.2 Cg_exo -49.44 -22.47 6.16 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 C-N-CA 122.282 1.988 . . . . 0.0 113.411 172.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -87.0 -58.17 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.267 -167.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.489 HD13 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -62.81 83.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.348 -173.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.5 mtmt -156.67 139.55 15.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.266 -164.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -63.12 123.47 18.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.432 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 8.0 pt-20 -97.93 27.67 4.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.819 164.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.15 -50.76 2.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.351 170.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.99 -21.23 10.16 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.955 -175.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.45 43.02 16.69 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -99.81 122.42 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.343 168.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 40.0 m -60.84 137.19 58.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.32 168.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 93.6 mt -101.15 148.64 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.442 -162.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.444 ' CG2' ' N ' ' A' ' 39' ' ' SER . 97.5 m -102.73 168.81 9.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.369 -171.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.444 ' N ' ' CG2' ' A' ' 38' ' ' THR . 0.1 OUTLIER -62.87 78.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.57 179.517 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.43 58.49 0.96 Allowed Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.33 9.61 1.71 Allowed Glycine 0 C--N 1.334 0.458 0 CA-C-N 114.435 -0.882 . . . . 0.0 111.996 168.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 6.1 p80 -112.12 -171.31 1.82 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.983 0.42 . . . . 0.0 110.555 -170.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.474 ' HB2' ' CD2' ' A' ' 56' ' ' TYR . . . -141.64 -164.72 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.612 166.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.75 146.74 2.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.218 162.912 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.519 ' NE2' ' HB2' ' A' ' 48' ' ' LYS . 34.2 p80 -86.96 -165.76 1.38 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.548 155.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.17 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.285 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.66 39.1 41.61 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 172.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HB2' ' NE2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -158.34 108.39 1.69 Allowed Pre-proline 0 CA--C 1.544 0.738 0 CA-C-O 121.315 0.579 . . . . 0.0 109.804 166.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.502 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 11.8 Cg_endo -71.46 154.14 60.59 Favored 'Trans proline' 0 N--CA 1.483 0.878 0 C-N-CA 122.963 2.442 . . . . 0.0 113.71 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 8.4 m-85 -147.14 -164.73 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.908 164.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.8 m -57.49 138.13 55.47 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.261 161.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -60.66 -30.66 70.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.172 163.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.51 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 27.9 m-70 -164.37 164.84 13.57 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.355 168.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.91 -12.96 14.6 Favored 'Cis proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.447 -1.897 . . . . 0.0 113.556 -15.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 68.9 m -59.72 -42.55 93.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.711 -157.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.474 ' CD2' ' HB2' ' A' ' 43' ' ' ALA . 23.0 t80 -60.87 -45.07 95.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.507 176.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.51 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 25.3 t -76.2 -25.16 54.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.527 -172.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.286 -174.591 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.486 1.065 0 N-CA-C 113.453 0.52 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.512 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.97 144.19 33.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.408 169.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.5 t -83.18 117.63 69.19 Favored Pre-proline 0 C--O 1.248 1.025 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.17 -162.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -60.46 -22.14 70.59 Favored 'Trans proline' 0 N--CA 1.489 1.227 0 C-N-CA 122.749 2.299 . . . . 0.0 113.222 169.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -73.25 0.31 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.396 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -94.44 -20.87 19.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.692 -165.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 t0 72.57 57.09 0.14 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.547 -172.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.95 -168.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.02 159.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.6 152.97 21.79 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.573 161.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.523 HG21 ' NE2' ' A' ' 24' ' ' HIS . 39.1 t -112.14 112.05 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.472 -163.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -75.75 159.51 30.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.382 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.34 -62.55 1.78 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.866 -159.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.48 -1.88 12.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.645 -173.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -101.86 14.08 32.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.478 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -98.74 146.31 26.02 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.374 -160.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.416 HG21 ' HB2' ' A' ' 23' ' ' TRP . 12.1 m -141.92 126.74 17.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.248 152.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 82.8 m -95.57 132.38 40.76 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.401 -175.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -162.65 122.58 2.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.224 -159.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.482 HD23 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.05 23.77 12.98 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.67 -176.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.73 17.06 66.63 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.696 -0.961 . . . . 0.0 110.696 164.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -151.21 150.38 30.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 162.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.2 178.29 8.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.252 -160.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.517 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 27.9 m95 -152.2 -177.32 6.11 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.237 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.9 m80 -101.09 143.63 30.98 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.053 -1.431 . . . . 0.0 110.526 170.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.4 ttp180 -61.18 -46.48 95.82 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.78 -173.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -58.88 -27.64 84.97 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.647 2.231 . . . . 0.0 113.585 174.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -81.04 -46.96 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.501 HD23 ' CE1' ' A' ' 42' ' ' HIS . 8.0 tp -60.78 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.442 -173.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -135.9 127.48 28.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.409 -164.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -61.35 125.88 25.37 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.353 167.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.0 tp10 -95.65 30.4 2.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.123 168.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.98 -43.03 1.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.173 -177.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.3 p -120.09 -9.32 9.62 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.815 -1.084 . . . . 0.0 111.212 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.82 37.9 95.36 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -95.0 121.47 36.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.28 172.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.2 m -61.31 135.97 57.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.17 166.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.436 HD11 ' HG ' ' A' ' 28' ' ' LEU . 27.3 mt -102.11 123.45 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.378 -165.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.38 -175.65 5.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.498 169.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.4 p -61.06 -9.85 5.15 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.506 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.51 -170.04 1.5 Allowed Glycine 0 CA--C 1.532 1.094 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.736 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.19 76.52 2.13 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -158.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.501 ' CE1' HD23 ' A' ' 28' ' ' LEU . 20.3 p80 -98.61 -167.02 1.43 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.264 -0.968 . . . . 0.0 110.572 169.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.58 -166.67 1.54 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.799 -169.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.53 154.26 3.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.167 164.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 15.0 p80 -92.21 -167.66 1.81 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.533 156.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.98 91.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.173 -176.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.67 53.87 9.28 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 178.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 6.1 ttmm -179.78 106.96 0.19 Allowed Pre-proline 0 CA--C 1.541 0.613 0 CA-C-O 121.764 0.792 . . . . 0.0 110.021 165.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.534 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 12.8 Cg_endo -71.21 148.82 56.6 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.744 2.296 . . . . 0.0 113.665 173.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.7 m-85 -144.1 -171.91 3.66 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.767 162.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 79.5 m -58.2 137.7 56.83 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.156 165.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -67.88 -34.37 76.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.58 -1.191 . . . . 0.0 109.993 163.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.436 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.8 m-70 -150.36 167.68 12.52 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.406 165.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.29 -20.39 6.64 Favored 'Cis proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.818 -2.159 . . . . 0.0 112.628 -21.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.6 m -57.31 -48.13 79.73 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.235 -153.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -61.07 -55.46 32.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.409 174.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.436 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.9 t -60.82 -17.74 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.564 -174.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.193 -168.206 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.086 0 N-CA-C 113.478 0.53 . . . . 0.0 113.478 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -145.13 136.89 25.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.277 -170.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.522 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 32.0 t -85.11 119.92 72.97 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.043 -162.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.511 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -63.25 -19.6 68.81 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 C-N-CA 122.971 2.447 . . . . 0.0 113.375 171.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.527 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 0.2 OUTLIER -85.05 -64.47 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.473 -171.053 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.5 p -96.48 -23.76 16.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.684 -170.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 72.21 64.55 0.13 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.512 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 0.5 OUTLIER -127.38 -170.81 2.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.105 162.019 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -99.66 150.48 22.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.306 163.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.52 HG23 ' CD2' ' A' ' 24' ' ' HIS . 39.9 t -112.58 113.64 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.505 -163.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -68.43 150.79 47.7 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.461 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.35 -62.82 1.59 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.834 -159.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -1.88 11.55 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.603 -174.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -101.85 13.2 35.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.302 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -96.44 155.8 16.61 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.249 -161.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.49 145.16 21.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.423 155.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -114.69 137.59 51.73 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.652 -168.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.448 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 8.7 t -177.69 128.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.334 -169.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.453 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.9 mm? 60.06 28.63 18.2 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.588 -172.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.38 17.5 72.51 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 167.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mmtt -137.22 153.19 50.45 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 163.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.41 176.77 7.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.399 -167.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.511 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 33.9 m95 -148.38 175.53 11.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 114.231 -1.35 . . . . 0.0 109.411 -177.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 40.5 m80 -96.81 138.97 33.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.392 167.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 8.7 tpp180 -60.94 -47.06 96.63 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.861 -165.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -62.23 -35.24 75.42 Favored 'Trans proline' 0 N--CA 1.484 0.914 0 C-N-CA 122.53 2.153 . . . . 0.0 113.666 174.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.527 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.3 m -61.21 -41.32 96.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.173 -171.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.447 HD12 ' CE1' ' A' ' 42' ' ' HIS . 10.2 tp -67.79 103.35 1.41 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -164.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -146.92 157.08 43.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.31 -178.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.1 t -72.18 127.42 32.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.367 171.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -95.83 35.87 1.35 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 114.078 -1.419 . . . . 0.0 110.168 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.51 ' HB2' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -138.08 -46.47 0.52 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.283 -176.258 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -115.87 -18.78 10.67 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.124 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.29 38.85 28.2 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -108.0 136.9 46.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.007 -0.597 . . . . 0.0 110.565 173.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -61.68 150.3 36.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.325 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.526 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 42.6 mt -113.28 154.9 26.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.398 -167.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -170.57 3.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.396 -175.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 t -61.65 -42.37 98.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.416 -176.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.58 59.5 0.42 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -128.21 13.45 6.31 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 111.63 -0.588 . . . . 0.0 111.63 173.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.517 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 8.6 p80 -114.04 -167.65 1.24 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.031 -0.584 . . . . 0.0 110.481 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -174.11 159.1 3.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.044 165.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.453 ' CG ' ' HG ' ' A' ' 19' ' ' LEU . 1.8 pp20? -110.3 134.96 51.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.074 -163.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -128.11 99.09 5.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.229 -1.35 . . . . 0.0 109.878 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 58.47 41.58 22.48 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.747 -173.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.18 -22.61 38.81 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 168.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -92.36 102.27 6.26 Favored Pre-proline 0 C--O 1.243 0.742 0 CA-C-O 121.253 0.549 . . . . 0.0 109.812 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -58.61 167.91 4.65 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.482 2.121 . . . . 0.0 113.468 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 32.1 m-85 -164.46 170.17 16.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.892 -167.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -57.3 133.98 55.58 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 113.85 -1.523 . . . . 0.0 110.269 160.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -27.99 68.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.07 164.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.2 m-70 -163.8 163.79 15.55 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.354 165.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.403 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -72.36 -13.53 17.32 Favored 'Cis proline' 0 N--CA 1.482 0.824 0 C-N-CA 122.645 -1.815 . . . . 0.0 113.578 -13.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 76.2 m -59.83 -46.34 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -157.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.13 -47.91 80.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.339 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.494 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.26 -14.14 61.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.298 178.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.328 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.183 176.953 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . 0.424 ' HD3' ' NZ ' ' A' ' 21' ' ' LYS . 10.2 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.54 0.554 . . . . 0.0 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.459 ' CD ' ' HG2' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -118.86 159.2 24.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.423 -168.828 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.521 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.8 t -81.94 118.72 73.12 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.391 -162.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -59.24 -19.38 49.78 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.766 2.311 . . . . 0.0 113.252 167.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HE3' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -83.36 -77.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.431 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.24 -18.8 22.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.035 -162.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 t70 71.88 51.92 0.22 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.485 -175.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -168.6 1.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.008 161.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.459 ' HG2' ' CD ' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.71 153.07 21.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.657 162.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 39.7 t -112.39 112.95 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.581 -163.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -70.66 154.98 41.33 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.29 177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -60.68 -62.29 1.97 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.796 -160.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.48 10.82 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.614 -173.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -102.46 14.52 31.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.475 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ptt-85 -96.42 155.13 16.89 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.214 -161.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.8 m -147.31 151.73 13.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.812 157.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.58 137.84 47.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.664 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.447 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.8 t -176.02 137.58 0.32 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.143 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 59.97 18.97 8.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.574 -171.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.45 28.93 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' NZ ' ' HD3' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -107.0 157.64 17.64 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.943 -0.629 . . . . 0.0 110.269 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.26 176.83 7.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.382 -166.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.524 ' HB2' HG21 ' A' ' 16' ' ' VAL . 27.8 m95 -149.54 -176.08 5.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.105 -177.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.521 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 43.0 m80 -100.36 138.61 37.19 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.91 -1.495 . . . . 0.0 110.543 169.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.436 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 1.3 ttp-105 -61.17 -47.6 94.23 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.803 -175.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.2 Cg_exo -52.44 -33.5 57.3 Favored 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 122.584 2.189 . . . . 0.0 113.6 170.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.427 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -77.63 -55.53 5.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.252 -170.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.48 78.26 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.381 -175.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 ptpt -137.31 155.44 49.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.416 170.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -59.51 125.88 25.38 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.651 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.433 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -93.53 22.67 5.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.226 170.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.08 -60.11 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.33 166.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.4 p -106.32 -21.22 13.16 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.902 -167.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.84 40.98 20.12 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 124.06 33.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.445 -0.377 . . . . 0.0 110.26 165.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 36.6 m -61.56 135.84 57.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.133 166.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.524 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 95.9 mt -102.97 110.16 21.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.388 -161.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -98.86 -167.06 1.43 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.44 171.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 p 58.79 -162.73 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.564 158.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -122.36 47.74 1.0 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 157.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -103.14 15.31 54.92 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 27.2 p80 -104.6 -170.48 1.77 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.473 0.654 . . . . 0.0 111.055 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -152.48 -166.05 2.37 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.161 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -170.87 164.91 7.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.885 164.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.517 ' NE2' ' HG2' ' A' ' 48' ' ' LYS . 31.8 p80 -111.05 106.14 15.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.715 163.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.15 14.85 2.95 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.006 165.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.448 ' HA2' ' HB2' ' A' ' 4' ' ' PRO . . . 126.99 16.28 2.43 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.517 ' HD3' ' HE3' ' A' ' 5' ' ' LYS . 9.4 tppt? -129.66 86.49 55.38 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -173.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.526 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 13.4 Cg_endo -71.29 155.56 60.33 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.665 2.243 . . . . 0.0 113.721 -168.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.7 m-85 -152.99 -164.12 1.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.813 167.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.1 m -58.18 137.34 57.1 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.103 159.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -61.32 -31.58 71.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.964 162.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.447 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.2 m-70 -161.53 164.56 18.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.34 170.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -70.31 -11.7 13.06 Favored 'Cis proline' 0 N--CA 1.483 0.906 0 C-N-CA 122.465 -1.89 . . . . 0.0 113.365 -15.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.5 m -61.99 -45.38 93.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.685 -157.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -61.03 -47.49 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.425 176.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.05 -15.07 62.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.543 -176.009 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.209 -173.162 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 113.538 0.553 . . . . 0.0 113.538 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 3.1 pttt -119.76 154.88 33.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.355 -167.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.2 t -78.44 117.64 67.52 Favored Pre-proline 0 C--O 1.248 0.974 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.637 -164.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -62.7 -6.88 9.8 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 123.031 2.487 . . . . 0.0 113.397 168.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.464 ' CE ' ' HD2' ' A' ' 49' ' ' PRO . 10.8 tptp -97.69 -75.87 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.346 -178.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -89.89 -12.35 39.21 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.536 -168.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 p30 59.98 53.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.624 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 -168.55 1.44 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.78 157.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -110.17 155.4 22.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.518 0.675 . . . . 0.0 109.626 159.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 24' ' ' HIS . 26.4 t -112.94 114.08 45.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.476 -157.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.04 156.0 39.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.376 177.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CD1' ' HD3' ' A' ' 15' ' ' ARG . 9.9 t80 -60.57 -59.4 5.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 -158.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.44 -0.77 13.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.571 -171.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -102.96 11.94 36.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.585 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.46 ' HD3' ' CD1' ' A' ' 12' ' ' PHE . 2.2 ptm180 -93.55 151.81 19.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.361 -160.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.535 HG21 ' HB2' ' A' ' 23' ' ' TRP . 15.9 m -145.75 145.58 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.494 155.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.22 135.45 54.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.635 -167.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.8 t -178.49 134.13 0.14 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.182 -168.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.489 HD22 ' HG3' ' A' ' 44' ' ' GLU . 3.2 mm? 59.96 18.62 7.71 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.656 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.23 -24.66 30.39 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 167.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mmpm? -110.1 159.18 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 114.815 -0.693 . . . . 0.0 110.107 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.93 176.5 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.289 -166.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.535 ' HB2' HG21 ' A' ' 16' ' ' VAL . 34.3 m95 -148.29 -179.97 7.33 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.184 -1.371 . . . . 0.0 109.106 -177.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 10' ' ' VAL . 38.5 m80 -99.78 141.42 32.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.542 166.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.536 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.55 -49.44 86.96 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.177 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -59.13 -30.4 93.07 Favored 'Trans proline' 0 N--CA 1.484 0.929 0 C-N-CA 122.456 2.104 . . . . 0.0 113.74 176.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.9 -45.35 67.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.277 -175.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.466 ' CD2' HG23 ' A' ' 16' ' ' VAL . 9.8 tp -64.91 84.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.325 -167.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -136.82 141.0 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.49 -169.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -67.78 124.12 22.44 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.445 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.85 42.72 1.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.237 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.52 -37.46 0.46 Allowed 'General case' 0 C--O 1.231 0.097 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.701 -178.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -117.52 -31.06 5.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.041 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.13 51.51 4.41 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -173.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.2 126.93 52.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.901 0.381 . . . . 0.0 110.116 164.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.4 m -61.25 133.57 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.228 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.08 143.93 25.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.421 -163.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.507 HG21 ' N ' ' A' ' 39' ' ' SER . 95.0 m -62.56 155.84 24.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.832 161.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.507 ' N ' HG21 ' A' ' 38' ' ' THR . 71.1 m -60.55 -21.07 62.14 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.083 178.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -121.76 179.69 16.19 Favored Glycine 0 CA--C 1.527 0.836 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.537 162.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.25 13.93 82.77 Favored Glycine 0 C--N 1.342 0.878 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.174 172.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.7 p80 -110.64 -167.33 1.17 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 113.967 -1.116 . . . . 0.0 110.468 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.51 160.36 7.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.151 159.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.51 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -114.88 122.46 46.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.213 -164.321 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.523 ' HB2' ' HG3' ' A' ' 48' ' ' LYS . 1.7 m80 -75.99 -168.25 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.877 160.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.39 85.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.027 -170.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.29 54.41 37.48 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' HB2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -168.04 105.52 0.56 Allowed Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.706 0.765 . . . . 0.0 109.935 170.35 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.51 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.0 Cg_endo -65.46 146.16 84.49 Favored 'Trans proline' 0 N--CA 1.484 0.92 0 C-N-CA 122.824 2.349 . . . . 0.0 113.624 169.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 22.4 m-85 -143.65 -166.05 2.24 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.843 168.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 94.5 m -57.49 129.71 43.03 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.748 -1.569 . . . . 0.0 110.278 165.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.813 159.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.468 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.34 163.24 25.25 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.268 164.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.468 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -72.99 -19.13 15.7 Favored 'Cis proline' 0 C--N 1.352 0.746 0 C-N-CA 122.708 -1.788 . . . . 0.0 113.712 -11.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.1 m -59.1 -45.63 90.39 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.812 -155.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -61.17 -48.63 80.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.427 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -98.67 23.76 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.738 -172.002 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.234 174.121 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 113.589 0.573 . . . . 0.0 113.589 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.47 159.21 26.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.545 -166.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.0 t -88.04 118.78 70.03 Favored Pre-proline 0 C--O 1.25 1.131 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.221 -162.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -58.81 -23.76 68.53 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.788 2.325 . . . . 0.0 113.14 169.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.79 -73.99 0.28 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.421 -176.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -94.42 -22.05 18.54 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.632 -164.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 71.93 61.6 0.14 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.556 -169.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.71 -167.76 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.058 162.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -103.36 147.66 26.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.299 163.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 49.1 t -109.46 111.97 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.68 -166.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.01 160.77 30.12 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.392 177.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.57 -63.02 1.44 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.75 -160.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.26 -11.0 60.59 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.71 -174.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.22 40.58 1.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.284 172.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.2 149.72 28.97 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.47 -176.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG22 HD21 ' A' ' 28' ' ' LEU . 18.3 m -143.47 145.71 22.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.475 155.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -113.81 139.5 49.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.546 -166.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.5 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 36.8 t -178.1 131.66 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.314 -171.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.496 ' HG ' ' HG3' ' A' ' 44' ' ' GLU . 3.1 mm? 59.99 18.82 7.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.551 -171.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.77 -24.47 26.04 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -105.33 157.72 17.13 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.808 -0.696 . . . . 0.0 110.026 179.262 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.16 177.47 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.299 -163.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.521 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 29.5 m95 -151.87 -175.13 5.1 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.067 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.2 m80 -101.16 144.83 29.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.474 169.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 34.6 tpt85 -61.62 -48.84 89.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.714 -170.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.4 Cg_endo -59.98 -31.71 93.96 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.597 2.198 . . . . 0.0 113.634 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -71.61 -44.99 63.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.278 -167.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.488 HD21 HG22 ' A' ' 16' ' ' VAL . 6.9 tp -66.48 77.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.441 -167.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -133.73 146.76 51.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.283 -173.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.9 t -60.19 128.81 38.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.403 169.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.511 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.2 mm-40 -99.85 26.13 6.61 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.129 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.82 -60.33 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.351 164.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.6 p -99.99 -20.41 16.1 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.766 -170.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.79 42.91 24.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 41.4 mmtt -119.04 130.01 55.41 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.988 -0.606 . . . . 0.0 110.373 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 m -61.43 149.85 37.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.449 -173.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 64.9 mt -110.63 125.59 53.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.378 -166.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -83.54 -166.84 1.49 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.705 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t -95.31 35.59 1.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 -165.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.49 58.44 0.01 OUTLIER Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 160.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -139.24 11.21 3.29 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 114.672 -0.764 . . . . 0.0 111.838 163.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 26.9 p80 -113.46 -169.54 1.52 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.201 -0.5 . . . . 0.0 110.982 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.75 -166.86 2.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.816 -1.083 . . . . 0.0 110.05 168.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -139.38 134.83 33.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.168 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.409 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 86.4 t60 -114.46 162.52 16.57 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 161.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 50.5 mm-40 -60.06 90.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.332 -160.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.47 25.71 6.85 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 174.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 176.45 140.43 0.22 Allowed Pre-proline 0 C--O 1.242 0.705 0 CA-C-O 121.264 0.554 . . . . 0.0 109.778 161.497 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 13.6 Cg_endo -66.96 161.0 44.43 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 123.038 2.492 . . . . 0.0 113.609 164.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.0 m-85 -150.4 -173.88 4.59 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.881 168.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.8 m -58.12 132.52 53.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 113.789 -1.55 . . . . 0.0 110.159 161.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -61.12 -33.2 73.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.882 164.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.46 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 31.7 m-70 -158.35 162.89 25.97 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.318 163.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.42 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.28 -18.18 16.81 Favored 'Cis proline' 0 C--N 1.353 0.81 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.646 -11.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 82.7 m -59.24 -43.14 92.41 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.907 -154.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.98 -61.31 2.67 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.376 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.46 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.19 -35.67 81.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.456 -174.001 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.185 -167.251 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo . . . . . 0 N--CA 1.483 0.904 0 N-CA-C 113.595 0.575 . . . . 0.0 113.595 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.08 147.85 51.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.477 171.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.509 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -85.13 121.25 74.04 Favored Pre-proline 0 C--O 1.25 1.126 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.044 -166.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.22 -33.27 90.56 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 122.888 2.392 . . . . 0.0 113.097 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -63.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.42 -168.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -97.78 -24.17 15.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.749 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 72.6 57.33 0.13 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.519 -171.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.32 -168.75 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.972 160.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -104.35 153.69 20.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.637 161.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.523 HG23 ' CD2' ' A' ' 24' ' ' HIS . 39.4 t -112.94 112.03 38.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.546 -163.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.487 ' CZ ' ' CE1' ' A' ' 12' ' ' PHE . 14.2 t80 -73.14 155.17 39.93 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.181 177.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.2 -59.44 5.41 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -158.827 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 -0.43 12.94 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.506 -172.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -105.81 17.81 23.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.353 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -96.3 152.09 18.91 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.249 -163.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.92 145.35 21.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.59 156.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -115.38 137.11 52.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.517 -165.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 t -178.46 128.04 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.247 -170.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 59.84 36.02 21.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.627 -171.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.12 17.9 53.39 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 168.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.69 156.49 47.36 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 164.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.18 176.69 6.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.319 -165.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.6 m95 -149.63 -176.84 5.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.12 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.6 m80 -99.93 146.5 26.6 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 113.954 -1.475 . . . . 0.0 110.585 168.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -61.02 -48.35 92.73 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.774 -168.234 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.3 Cg_endo -63.63 -35.31 59.4 Favored 'Trans proline' 0 N--CA 1.483 0.868 0 C-N-CA 122.555 2.17 . . . . 0.0 113.638 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.95 -50.73 65.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.209 -164.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.473 ' HA ' ' HG2' ' A' ' 49' ' ' PRO . 2.3 tp -60.31 89.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.353 -163.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.475 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 57.3 mttt -148.69 149.81 32.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.393 -165.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.9 t -69.04 126.43 29.77 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.451 175.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.9 33.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.066 169.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -130.25 -49.53 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.198 179.104 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.471 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 29.3 p -113.5 -18.49 11.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.214 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.97 39.7 53.65 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -99.29 131.42 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.302 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 28.3 m -60.87 139.57 57.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.465 171.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 51.7 mt -103.07 121.75 43.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.359 -169.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -83.25 -169.08 2.36 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.48 -173.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.1 p -74.47 77.39 1.93 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.376 -167.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.42 56.1 1.72 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 168.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.75 11.87 4.25 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 166.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.536 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.2 p80 -107.36 -170.32 1.68 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.106 -0.547 . . . . 0.0 110.451 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.87 158.7 10.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.833 163.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -112.77 128.33 56.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.211 -160.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.479 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.44 151.97 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.419 157.015 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -62.67 75.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.003 -172.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.462 ' HA3' ' NZ ' ' A' ' 48' ' ' LYS . . . 162.45 -53.52 0.31 Allowed Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.715 -167.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -155.16 140.48 12.37 Favored Pre-proline 0 C--O 1.242 0.68 0 CA-C-O 121.39 0.614 . . . . 0.0 110.048 -163.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.473 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.9 Cg_endo -68.46 149.35 74.64 Favored 'Trans proline' 0 N--CA 1.486 1.032 0 C-N-CA 123.08 2.52 . . . . 0.0 113.708 166.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 8.4 m-85 -138.8 -173.65 3.62 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.79 167.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 86.0 m -57.52 134.59 56.24 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 113.458 -1.701 . . . . 0.0 110.348 164.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.88 -37.15 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.021 162.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.6 m-70 -152.68 169.82 9.04 Favored Pre-proline 0 CA--C 1.546 0.81 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 163.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 22.2 Cg_endo -66.12 -21.47 7.17 Favored 'Cis proline' 0 N--CA 1.491 1.347 0 C-N-CA 122.113 -2.036 . . . . 0.0 112.655 -19.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 73.4 m -57.11 -42.92 81.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.251 -153.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -61.03 -56.32 22.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.458 175.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.516 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -96.98 24.28 6.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.507 -166.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.256 174.01 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.59 158.77 29.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.355 -167.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.3 t -80.59 119.36 76.04 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.349 -161.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -61.1 -18.83 60.42 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.877 2.385 . . . . 0.0 113.198 167.852 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.502 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.9 OUTLIER -83.02 -77.65 0.24 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.424 -179.428 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -90.96 -20.12 22.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.918 -164.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.22 52.54 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.463 -173.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.81 -168.13 1.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.979 159.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 149.59 27.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.355 167.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 ' NE2' ' A' ' 24' ' ' HIS . 41.5 t -111.31 113.53 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.467 -161.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.7 158.75 29.53 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.457 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.11 -62.71 1.67 Allowed 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 -158.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.21 -13.29 61.87 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.813 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -102.78 52.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.783 167.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -115.81 148.63 39.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.527 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.522 HG23 ' HB2' ' A' ' 23' ' ' TRP . 10.2 m -137.35 141.25 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.478 151.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.8 m -105.34 131.03 53.29 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.523 -176.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.406 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.0 OUTLIER -168.71 122.72 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.197 -164.167 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 44' ' ' GLU . 2.5 mm? 60.17 32.97 21.08 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.77 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.93 18.5 78.71 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 163.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.426 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -154.72 160.05 41.1 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 164.372 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.75 176.89 7.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.285 -165.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.522 ' HB2' HG23 ' A' ' 16' ' ' VAL . 23.6 m95 -152.91 -176.45 5.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.03 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.52 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 39.2 m80 -101.76 142.26 33.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.476 168.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -61.16 -50.59 83.47 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.732 -169.469 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 7.3 Cg_exo -57.38 -34.93 98.75 Favored 'Trans proline' 0 N--CA 1.483 0.9 0 C-N-CA 122.618 2.212 . . . . 0.0 113.545 174.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.502 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.8 m -65.74 -46.47 78.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.352 -169.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.516 HD21 HG22 ' A' ' 16' ' ' VAL . 11.3 tp -60.84 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.332 -165.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -139.73 146.63 39.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.327 -164.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.0 t -70.66 119.77 15.3 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 167.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -97.71 29.03 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.988 165.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tptp -110.48 -52.35 2.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.116 170.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.8 -24.36 10.91 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.752 -177.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.72 44.62 7.17 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 2.4 mmtm -111.15 119.82 40.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.306 -0.447 . . . . 0.0 110.401 168.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.5 m -61.08 161.72 8.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.319 168.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 42' ' ' HIS . 5.0 mt -131.78 147.32 52.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.351 -165.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -83.47 -166.2 1.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.586 174.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.0 t -95.76 32.11 1.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.346 -169.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 167.22 57.36 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 164.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.25 12.0 2.29 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 114.763 -0.718 . . . . 0.0 111.825 170.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.526 ' HB2' HD12 ' A' ' 37' ' ' LEU . 2.3 p80 -112.75 -174.62 2.49 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.47 -175.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -152.62 -177.27 6.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 164.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.537 ' HB2' HD22 ' A' ' 19' ' ' LEU . 1.9 mp0 -140.72 114.77 9.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.059 -164.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.493 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -74.0 -167.84 0.54 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.821 157.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.39 86.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.199 -173.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.25 47.34 91.58 Favored Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.734 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.9 103.26 1.93 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 121.851 0.834 . . . . 0.0 109.848 -175.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.512 ' HB3' HD13 ' A' ' 28' ' ' LEU . 12.3 Cg_endo -66.87 145.2 73.76 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 122.594 2.196 . . . . 0.0 113.79 177.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -143.63 -168.32 2.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.848 171.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 69.2 m -57.51 134.56 56.2 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.197 161.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -61.28 -33.48 73.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.89 160.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.515 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 23.6 m-70 -157.13 163.81 23.78 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.193 164.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.2 -17.42 17.31 Favored 'Cis proline' 0 C--N 1.354 0.828 0 C-N-CA 122.627 -1.822 . . . . 0.0 113.558 -14.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.3 m -59.5 -38.06 79.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.723 -155.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -62.35 -54.8 35.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.385 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.515 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.0 t -61.83 -12.69 18.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.464 -173.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.287 -179.169 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.099 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -131.11 156.41 45.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.432 170.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.1 t -83.09 118.93 73.18 Favored Pre-proline 0 C--O 1.25 1.086 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.435 -162.78 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.6 Cg_endo -60.15 -19.62 57.66 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.754 2.303 . . . . 0.0 113.373 167.806 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.08 -77.29 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.466 179.519 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.58 -19.74 21.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.725 -163.256 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 16.2 t70 71.78 64.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.455 -170.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -126.08 -168.01 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.167 162.722 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -103.93 148.83 25.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.289 163.759 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.52 HG21 ' NE2' ' A' ' 24' ' ' HIS . 56.1 t -115.92 110.95 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.723 -164.036 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.496 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 27.0 t80 -72.74 154.95 40.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.374 -179.314 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.496 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 15.9 m-85 -60.28 -61.38 2.64 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.945 -158.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.78 -1.18 13.1 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.613 -173.015 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -102.4 12.17 36.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.547 178.046 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -97.11 158.19 15.56 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.178 -160.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.445 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 17.7 m -146.53 145.94 19.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.471 156.386 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -114.39 137.42 51.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.904 -1.043 . . . . 0.0 110.669 -166.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.0 t -178.35 127.48 0.12 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.235 -171.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.461 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 2.6 mm? 59.94 34.87 21.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.557 -170.172 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.75 18.0 51.51 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.541 -1.023 . . . . 0.0 110.541 169.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.44 153.15 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 164.674 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.68 177.17 6.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.289 -165.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 26.1 m95 -150.39 175.56 11.73 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.064 -1.425 . . . . 0.0 109.383 -177.705 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.52 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.8 m80 -93.37 137.64 32.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.526 171.144 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.525 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 ttp180 -61.03 -46.43 96.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.83 -170.693 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -50.36 -48.32 20.61 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.704 2.269 . . . . 0.0 113.496 166.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.77 -51.53 67.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.231 -166.376 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.462 HD12 ' CE1' ' A' ' 42' ' ' HIS . 3.2 tp -60.24 91.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.404 -162.13 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.7 mtpt -140.96 154.18 45.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.357 -169.372 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.0 t -69.45 132.05 45.72 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.376 176.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 45.1 mm-40 -95.43 31.31 2.01 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.194 -1.367 . . . . 0.0 110.261 173.437 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.33 -48.54 0.53 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.189 -174.343 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.1 p -114.1 -10.74 12.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.245 178.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.41 23.35 77.56 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 172.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . 1.1 tppt? -103.74 136.23 43.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.911 -0.645 . . . . 0.0 110.402 -177.602 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 m -61.94 142.56 57.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.451 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.527 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 60.1 mt -99.92 157.77 16.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.422 -173.082 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 -172.39 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.221 -167.748 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 -22.09 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.445 -167.59 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 174.68 60.76 0.05 OUTLIER Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 170.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -115.2 11.61 19.8 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 166.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.462 ' CE1' HD12 ' A' ' 28' ' ' LEU . 9.1 p80 -102.04 -168.61 1.56 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.389 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.36 158.64 11.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.958 161.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -121.18 138.99 53.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.1 -163.632 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -130.43 109.21 10.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.76 173.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' ' HD2' ' A' ' 48' ' ' LYS . 1.4 tp10 58.4 43.34 19.91 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.663 -170.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.84 22.65 73.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.489 ' HD2' ' HB3' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -117.64 98.43 51.7 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-N 115.159 -0.52 . . . . 0.0 109.759 173.195 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.7 Cg_endo -64.33 155.18 67.14 Favored 'Trans proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.62 2.213 . . . . 0.0 113.572 -173.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 76.3 m-85 -151.6 177.63 10.15 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.001 175.431 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.0 m -56.52 132.08 50.46 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.379 -1.737 . . . . 0.0 110.426 161.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.64 -30.06 69.64 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.978 163.332 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.447 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 34.4 m-70 -160.87 165.17 17.76 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.699 -1.137 . . . . 0.0 109.323 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.442 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.0 Cg_endo -72.89 -15.0 17.89 Favored 'Cis proline' 0 N--CA 1.483 0.898 0 C-N-CA 122.628 -1.822 . . . . 0.0 113.608 -13.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.6 m -59.54 -44.34 93.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.714 -157.02 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -61.78 -51.0 70.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.517 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -73.79 -15.25 61.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.342 -176.219 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.354 173.421 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.5 0.538 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.444 ' HD3' ' HG2' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -119.52 155.99 31.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.413 -167.414 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.0 t -83.7 119.42 73.64 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.417 -164.887 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.6 Cg_endo -62.0 -17.78 57.87 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.794 2.329 . . . . 0.0 113.261 167.547 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -83.27 -76.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.449 179.593 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -92.79 -20.25 20.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.825 -163.19 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 t0 72.46 59.51 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.468 -171.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.53 -176.35 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.993 160.725 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.444 ' HG2' ' HD3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -98.26 148.0 24.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.528 172.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.514 HG21 ' NE2' ' A' ' 24' ' ' HIS . 38.1 t -111.96 112.96 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.546 -158.53 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 19.1 t80 -73.14 151.44 41.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.41 -179.343 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.41 -54.63 43.34 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.875 -159.211 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.91 -1.22 27.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.522 -170.115 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 13.22 28.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.339 175.73 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.45 153.49 22.45 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.283 -165.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 23' ' ' TRP . 18.0 m -147.84 147.57 17.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.787 156.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -113.84 136.06 53.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.666 -168.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.1 t -177.74 131.33 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.417 -173.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.46 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 3.1 mm? 60.12 36.0 21.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.719 -175.918 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.11 18.59 67.13 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.9 157.84 43.88 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 165.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -89.78 176.7 6.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.29 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -149.49 179.13 8.2 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.101 -177.041 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.9 m80 -96.27 142.99 27.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.445 170.66 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 15.0 tpt180 -61.28 -45.22 95.15 Favored Pre-proline 0 CA--C 1.543 0.689 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.728 -166.369 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.514 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.5 Cg_endo -64.81 -37.17 36.48 Favored 'Trans proline' 0 N--CA 1.483 0.893 0 C-N-CA 122.586 2.191 . . . . 0.0 113.604 175.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.522 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.4 m -61.08 -48.31 82.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.208 -166.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.471 HD21 HG22 ' A' ' 16' ' ' VAL . 6.6 tp -60.4 89.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.425 -163.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 39.5 mttt -143.46 144.06 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.3 -165.595 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.6 t -63.25 119.52 9.78 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.47 167.413 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 6.9 pt-20 -97.22 35.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.758 164.037 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -120.35 -48.71 2.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.205 173.161 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -112.6 -22.71 10.63 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 114.541 -1.208 . . . . 0.0 110.994 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.27 42.81 9.06 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -178.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -97.65 133.63 41.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.364 169.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.521 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 14.0 m -69.06 143.17 54.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.313 167.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 85.0 mt -109.19 158.88 17.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.262 -167.478 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -116.74 -169.05 1.56 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.549 -166.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.9 t -60.84 -23.1 64.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 -165.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.88 70.69 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -136.27 22.45 3.39 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 163.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 8.0 p80 -111.33 -168.43 1.31 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 114.792 -0.704 . . . . 0.0 110.486 -177.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -147.87 -166.64 2.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.776 165.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -163.13 137.81 6.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.077 162.624 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -103.09 112.68 25.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.831 166.053 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 58.28 31.7 21.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.742 165.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.35 -20.12 12.66 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.579 -1.008 . . . . 0.0 110.579 170.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -104.92 94.21 7.3 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 121.408 0.623 . . . . 0.0 109.853 -169.175 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.519 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.3 Cg_endo -64.44 158.07 51.37 Favored 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.374 2.05 . . . . 0.0 113.597 -177.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 88.2 m-85 -155.4 -164.6 1.8 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.074 174.304 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 98.1 m -56.48 135.52 54.31 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.435 161.458 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -61.12 -30.92 70.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.885 161.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 29.8 m-70 -161.65 164.97 17.21 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.333 165.915 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.411 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.3 -15.24 16.79 Favored 'Cis proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.529 -1.863 . . . . 0.0 113.555 -14.679 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.68 -40.34 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.657 -156.645 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -60.98 -35.61 77.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.471 172.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.1 t -84.58 -13.54 51.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.338 -174.295 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.229 -177.474 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . 0.524 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 7.1 Cg_exo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 113.528 0.549 . . . . 0.0 113.528 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.494 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -147.05 136.47 22.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.485 -166.458 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -93.52 118.77 67.6 Favored Pre-proline 0 C--O 1.247 0.957 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.157 -167.741 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.66 -27.43 84.81 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.839 2.359 . . . . 0.0 113.196 168.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -73.02 0.19 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.388 -176.441 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.14 -16.2 22.77 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -165.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.23 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.569 -169.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 -167.82 1.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.01 158.332 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.31 145.58 30.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.379 165.984 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 24' ' ' HIS . 48.5 t -107.71 110.25 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.746 -165.502 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -73.8 157.4 36.47 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -60.66 -63.13 1.4 Allowed 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.763 -160.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -3.83 19.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.372 -1.286 . . . . 0.0 111.79 -174.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.18 16.1 26.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 178.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -97.69 149.64 22.06 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.28 -163.543 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.477 HG22 HD23 ' A' ' 28' ' ' LEU . 12.5 m -142.2 119.07 6.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.483 154.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.7 m -88.05 133.36 33.99 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.287 -176.528 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.519 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.9 120.67 2.69 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.337 -161.047 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.459 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.7 mm? 60.02 18.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.721 -177.641 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.21 -26.11 12.77 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 162.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.77 147.49 43.82 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.873 -0.663 . . . . 0.0 109.95 178.85 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -79.06 177.51 8.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.191 -163.264 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 46.2 m95 -151.46 -178.32 6.6 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 113.972 -1.467 . . . . 0.0 109.371 -177.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.1 m80 -98.49 145.59 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.488 171.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -62.62 -49.9 80.82 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.833 -173.512 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.7 Cg_exo -61.56 -32.28 87.69 Favored 'Trans proline' 0 N--CA 1.482 0.835 0 C-N-CA 122.744 2.296 . . . . 0.0 113.604 176.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.444 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -70.2 -49.49 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.149 -168.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.477 HD23 HG22 ' A' ' 16' ' ' VAL . 5.3 tp -64.51 82.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.329 -162.771 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -124.24 142.47 51.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.301 -170.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.6 t -63.24 128.62 36.67 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.37 170.533 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 4.9 mm-40 -95.81 37.32 1.22 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.159 169.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.38 -50.39 0.56 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.257 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -112.19 -18.75 12.48 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.043 -179.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.42 40.27 60.33 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 174.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -111.88 134.98 53.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.154 -0.523 . . . . 0.0 110.495 171.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 m -61.56 147.13 46.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.381 176.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.515 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 11.4 mt -109.23 170.25 8.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.355 -166.907 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 m -108.01 174.57 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.424 -165.404 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.1 t -64.98 69.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.371 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.71 55.42 1.65 Allowed Glycine 0 CA--C 1.531 1.045 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.3 12.84 5.74 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.589 -0.605 . . . . 0.0 111.589 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.515 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 3.2 p80 -115.14 -168.93 1.46 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.781 -0.71 . . . . 0.0 110.257 -177.609 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.67 157.78 12.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.894 161.403 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.522 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.46 128.68 56.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.007 -163.851 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.425 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 86.3 t60 -90.37 163.4 14.72 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.303 160.857 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.425 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 2.1 tt0 -60.43 92.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.119 -161.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.71 54.67 11.53 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.63 -169.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -179.74 101.84 0.18 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-O 121.451 0.643 . . . . 0.0 109.884 166.953 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.522 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.9 Cg_endo -65.1 150.25 88.06 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.803 2.335 . . . . 0.0 113.639 170.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 47.5 m-85 -147.61 -179.57 6.97 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.914 169.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.9 m -56.28 140.89 43.4 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.295 -1.775 . . . . 0.0 110.592 164.239 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -61.01 -32.95 72.52 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.12 168.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.438 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.5 m-70 -162.73 165.63 14.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.339 166.362 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -71.5 -11.33 15.39 Favored 'Cis proline' 0 C--N 1.354 0.831 0 C-N-CA 122.52 -1.866 . . . . 0.0 113.616 -14.344 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.4 m -59.82 -45.75 91.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 -157.842 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -61.28 -65.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.275 -178.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.438 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 73.1 m -65.27 -12.84 55.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.47 -170.237 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.426 171.599 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.88 148.12 49.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.36 -171.386 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.3 t -76.09 118.33 70.44 Favored Pre-proline 0 C--O 1.246 0.906 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.505 -163.469 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -60.22 -18.62 53.03 Favored 'Trans proline' 0 N--CA 1.489 1.21 0 C-N-CA 122.96 2.44 . . . . 0.0 113.211 167.295 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -84.99 -77.4 0.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.46 -178.14 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.8 p -89.87 -13.07 37.21 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.455 -167.231 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 60.2 54.59 3.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.574 -173.16 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HA ' ' HD2' ' A' ' 8' ' ' LYS . 6.5 tptp -108.47 -168.37 1.35 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.767 157.081 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.96 155.3 18.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.595 161.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 ' NE2' ' A' ' 24' ' ' HIS . 38.7 t -114.24 113.28 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.504 -163.66 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.426 ' CE1' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t80 -73.35 157.79 36.3 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.359 177.076 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CE2' ' CE1' ' A' ' 11' ' ' TYR . 5.8 m-85 -60.55 -61.89 2.26 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.77 -159.819 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.38 -1.22 9.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.616 -173.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.533 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 15.8 mm-40 -101.96 12.98 36.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.69 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.24 152.12 18.64 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.277 -160.295 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.466 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.7 m -145.91 150.04 15.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.662 156.379 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 138.84 44.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.816 -170.677 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.458 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 27.8 t -177.3 132.76 0.17 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.341 178.007 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.15 38.0 20.51 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.533 -175.536 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.36 18.67 63.42 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 166.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -145.19 158.89 43.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.595 -0.302 . . . . 0.0 110.2 166.398 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.14 177.15 6.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.374 -167.729 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.84 -174.71 4.78 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 114.162 -1.381 . . . . 0.0 108.993 -177.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 45.0 m80 -100.9 142.38 32.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 113.803 -1.544 . . . . 0.0 110.555 170.136 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HG2' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -61.23 -44.81 94.67 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.116 -174.211 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 6.0 Cg_endo -62.65 -28.65 77.03 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.503 2.135 . . . . 0.0 113.652 175.417 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.4 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -77.32 -50.85 11.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.294 -168.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.2 75.78 0.05 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.301 -177.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.538 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 8.6 ttmt -147.52 139.54 24.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.431 -174.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.8 t -61.19 125.67 24.58 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.317 178.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.7 21.8 12.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.13 172.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.4 -58.6 1.86 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.162 166.063 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.5 p -102.31 -33.34 9.63 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.407 -172.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.51 49.51 4.6 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.506 178.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.504 ' NZ ' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -106.59 126.87 52.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.417 161.352 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.538 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 67.7 m -61.86 136.33 57.94 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.176 172.162 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 34.3 mt -96.43 165.91 11.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.371 -160.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.0 m -112.12 177.93 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.296 -164.076 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.8 m -60.72 84.04 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.526 170.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 55.79 7.31 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 172.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -132.03 12.23 5.32 Favored Glycine 0 CA--C 1.524 0.651 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.608 162.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.3 p80 -105.48 -168.53 1.47 Allowed 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 114.72 -0.74 . . . . 0.0 110.399 177.336 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.66 157.58 8.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.804 160.079 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.7 pt-20 -120.83 125.48 47.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.131 -161.576 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.413 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 83.4 t60 -93.4 164.65 13.12 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 158.178 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.413 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 15.3 mm-40 -58.09 93.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 -157.124 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.0 56.38 5.82 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.746 -172.313 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HE2' ' NZ ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER 179.14 98.86 0.17 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-O 121.755 0.788 . . . . 0.0 110.02 163.009 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 32.5 Cg_endo -68.52 137.84 40.41 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.974 2.449 . . . . 0.0 113.503 166.06 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.9 m-85 -133.85 -163.8 1.41 Allowed 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.67 171.383 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.9 m -56.37 134.16 53.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.451 163.521 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -60.93 -31.11 70.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.024 163.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.48 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 19.4 m-70 -158.62 166.39 16.57 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.206 164.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -66.26 -21.71 7.22 Favored 'Cis proline' 0 N--CA 1.49 1.276 0 C-N-CA 121.992 -2.087 . . . . 0.0 112.733 -20.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.9 m -56.54 -39.12 72.86 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.386 -152.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -64.73 -71.84 0.17 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.033 174.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.48 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 20.4 m -62.41 -14.16 37.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.54 -166.505 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.236 -173.845 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.491 0.535 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -124.4 149.0 47.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.29 169.488 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.522 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.1 t -83.55 117.27 68.17 Favored Pre-proline 0 C--O 1.249 1.047 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.221 -162.347 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 5.5 Cg_endo -59.46 -23.08 69.1 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.418 2.079 . . . . 0.0 113.069 169.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -77.51 -72.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.545 -175.44 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.34 -20.45 19.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.755 -165.788 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.78 57.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.506 -172.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -118.57 -168.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.92 159.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.3 mp0 -104.35 154.14 20.19 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.434 160.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 31.7 t -112.27 111.99 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.45 -162.21 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.57 33.1 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.554 -1.203 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -51.21 70.81 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.007 -156.453 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -0.37 29.33 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.444 -168.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -111.05 20.96 16.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.304 173.084 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.84 148.0 24.86 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.355 -169.717 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.95 117.53 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.661 154.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -97.34 142.58 29.04 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.521 -173.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.6 t -177.26 137.36 0.22 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.212 -169.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.497 HD11 ' N ' ' A' ' 19' ' ' LEU . 4.7 mp 60.13 16.4 5.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.553 -172.874 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.6 -25.82 23.24 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 165.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.94 149.72 41.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 114.721 -0.739 . . . . 0.0 110.158 -178.135 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -85.76 177.53 7.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.217 -162.611 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 42.2 m95 -149.18 -175.84 5.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.376 179.27 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.522 ' NE2' HG21 ' A' ' 10' ' ' VAL . 45.6 m80 -98.22 148.52 23.52 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.468 173.389 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 tpp85 -61.58 -45.25 93.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.716 -168.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.0 Cg_endo -66.17 -40.28 15.87 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.538 2.159 . . . . 0.0 113.581 174.674 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.61 -53.26 59.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.301 -163.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -60.51 91.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.414 -163.015 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 mtmp? -152.18 148.05 27.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.353 -170.375 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.9 t -61.63 126.87 28.87 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.485 173.369 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.74 21.29 11.61 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.163 176.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.431 ' CE ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.13 -61.25 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.358 165.952 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.0 p -100.54 -22.76 14.88 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.569 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.53 45.18 11.34 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.537 -1.025 . . . . 0.0 110.537 -175.842 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -99.99 120.98 40.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.463 . . . . 0.0 110.298 165.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.5 m -61.23 131.0 49.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.302 175.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.533 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 21.3 mt -94.57 118.08 31.13 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 114.618 -1.173 . . . . 0.0 110.38 -174.024 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -60.15 -168.46 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.549 169.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -87.15 69.1 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.245 165.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 156.01 151.7 6.0 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.651 176.107 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.06 15.42 81.11 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.107 -1.044 . . . . 0.0 111.355 167.06 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -110.83 -166.51 1.08 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.722 -0.739 . . . . 0.0 110.853 172.343 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.95 159.63 9.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.191 -170.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.503 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -135.63 122.53 21.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.006 -165.092 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -128.86 102.15 6.41 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.197 -1.365 . . . . 0.0 109.972 177.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 58.6 47.47 13.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.643 -171.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.87 19.87 56.53 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.578 173.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -110.4 98.38 35.92 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 170.347 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.482 ' HB2' HD13 ' A' ' 37' ' ' LEU . 9.7 Cg_endo -62.17 157.82 42.78 Favored 'Trans proline' 0 N--CA 1.486 1.042 0 C-N-CA 122.47 2.113 . . . . 0.0 113.638 -173.14 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 57.0 m-85 -158.32 173.55 16.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.994 -170.528 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.4 m -57.87 130.88 48.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.051 160.201 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -61.52 -31.91 71.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.81 160.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.462 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.5 m-70 -157.12 163.2 25.82 Favored Pre-proline 0 CA--C 1.553 1.076 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.162 165.07 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -73.71 -16.73 18.65 Favored 'Cis proline' 0 C--N 1.353 0.788 0 C-N-CA 122.665 -1.806 . . . . 0.0 113.651 -13.316 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.6 m -59.36 -44.99 92.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.711 -156.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -60.83 -52.73 63.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.507 174.456 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.462 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 7.6 t -63.31 -29.15 70.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.38 -173.421 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -170.524 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.946 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.479 ' HG2' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.55 158.2 22.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -168.619 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.8 t -86.84 122.75 71.3 Favored Pre-proline 0 C--O 1.247 0.972 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.165 -162.445 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -62.03 -30.18 82.59 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.846 2.364 . . . . 0.0 113.288 168.971 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -70.87 0.28 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.476 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -96.65 -14.22 22.27 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.485 -166.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.5 57.12 3.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.58 -169.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.71 -168.01 1.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.853 158.929 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -107.69 152.14 24.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.608 162.013 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 42.9 t -111.2 112.47 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.615 -163.636 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.35 152.98 44.65 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.308 175.596 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -60.52 3.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.777 -158.759 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.53 -11.8 61.05 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.744 -172.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -102.81 42.6 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.173 170.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -108.82 152.72 24.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.384 -178.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.45 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 18.5 m -143.73 145.72 21.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.602 155.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.7 136.48 50.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.668 -166.204 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.435 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.0 t -177.99 136.45 0.17 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.466 -173.573 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.13 25.09 14.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.645 -177.671 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.75 -24.69 28.48 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 166.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HE2' ' HG2' ' A' ' 2' ' ' LYS . 3.3 tttp -118.09 165.98 13.11 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.752 -0.724 . . . . 0.0 110.21 -178.049 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.27 176.56 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.376 -166.293 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.4 m95 -148.53 -176.8 5.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 114.165 -1.379 . . . . 0.0 109.171 -178.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.519 ' NE2' HG21 ' A' ' 10' ' ' VAL . 45.4 m80 -102.98 141.83 35.11 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.473 169.309 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.96 -47.82 94.41 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.835 -174.549 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_exo -54.74 -27.3 51.43 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 C-N-CA 122.59 2.193 . . . . 0.0 113.609 172.624 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -83.38 -55.25 4.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.263 -167.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.418 HD21 HG23 ' A' ' 16' ' ' VAL . 3.4 tp -60.71 82.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.388 -171.126 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.75 144.9 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.393 -164.515 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.7 t -64.85 133.61 52.27 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.399 -171.281 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.34 25.42 6.28 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.439 175.143 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.499 ' HA ' ' NZ ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -130.68 -48.87 1.05 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.64 -179.597 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.8 p -109.68 -18.3 13.5 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.3 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.82 40.28 85.05 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 176.668 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.14 134.87 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.432 -0.384 . . . . 0.0 110.456 170.071 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.8 m -61.52 145.24 52.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.378 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.463 HD11 ' CB ' ' A' ' 42' ' ' HIS . 18.5 mt -106.9 143.31 35.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.398 -171.699 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -110.41 -169.45 1.47 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.523 -170.48 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.3 84.45 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 -167.476 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.87 55.52 4.12 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 167.39 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.58 12.28 4.58 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 167.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.463 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.3 p80 -108.09 -170.36 1.67 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.135 -0.533 . . . . 0.0 110.498 -178.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -177.96 157.13 1.12 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.423 161.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.461 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -136.96 153.25 50.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.07 -157.889 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.52 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 10.3 p80 -98.2 167.66 10.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.551 157.25 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.84 86.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.123 -170.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.49 -48.77 0.71 Allowed Glycine 0 CA--C 1.529 0.916 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.566 -178.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 3.6 mttt -137.33 111.53 9.17 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 121.439 0.638 . . . . 0.0 109.764 -160.225 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 15.3 Cg_endo -68.91 154.11 71.49 Favored 'Trans proline' 0 N--CA 1.484 0.959 0 C-N-CA 122.963 2.442 . . . . 0.0 113.599 167.805 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -143.21 -167.82 2.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.827 163.777 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.1 m -56.56 140.24 47.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.34 -1.754 . . . . 0.0 110.453 164.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.66 -34.81 74.85 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 114.407 -1.269 . . . . 0.0 110.118 164.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.52 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 41.3 m-70 -161.8 166.2 14.95 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.275 165.454 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.519 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.8 Cg_endo -71.81 -13.75 16.23 Favored 'Cis proline' 0 N--CA 1.481 0.783 0 C-N-CA 122.681 -1.8 . . . . 0.0 113.631 -12.309 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.1 m -59.68 -41.18 90.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.769 -157.194 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -61.17 -36.6 80.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.374 177.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.52 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -77.28 -28.48 53.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.342 -179.92 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.317 -167.937 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.55 0.558 . . . . 0.0 113.55 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -125.5 153.53 43.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.458 -168.928 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.9 t -77.36 117.59 66.37 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.438 -163.813 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 2.0 Cg_endo -62.11 -9.92 16.31 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 123.001 2.467 . . . . 0.0 113.344 168.133 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.98 -74.38 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.446 -177.295 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -91.94 -19.35 22.54 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.973 -167.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.4 t0 72.3 49.17 0.23 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.594 -177.229 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -106.13 -168.39 1.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.839 159.325 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.481 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.1 mt-10 -107.03 157.49 17.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.457 158.565 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 24' ' ' HIS . 25.4 t -114.49 112.5 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.252 -159.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -73.79 159.51 32.81 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.189 -179.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -60.21 -63.08 1.43 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.85 -158.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -2.98 15.1 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.661 -174.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -101.79 15.59 28.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.264 178.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.41 138.96 36.76 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.478 -163.398 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.433 HG12 ' HA ' ' A' ' 25' ' ' ARG . 10.2 m -132.72 117.71 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.523 154.178 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 46.6 m -89.79 133.05 34.91 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.209 -176.117 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.514 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -161.51 125.91 3.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.376 -159.759 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.463 HD22 ' HG2' ' A' ' 44' ' ' GLU . 5.5 mp 59.98 19.67 8.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.764 167.137 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 124.42 -31.43 4.42 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 162.469 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -135.42 158.98 43.01 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 114.653 -0.774 . . . . 0.0 110.082 -177.188 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.32 178.06 8.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.236 -164.568 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 40.2 m95 -151.38 -177.48 6.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 113.791 -1.549 . . . . 0.0 109.216 -178.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 10' ' ' VAL . 44.0 m80 -99.63 147.83 24.96 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.485 171.799 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.49 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 10.6 mmt180 -61.16 -48.77 90.97 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.712 -168.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.49 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 3.6 Cg_exo -64.56 -36.19 44.15 Favored 'Trans proline' 0 N--CA 1.483 0.901 0 C-N-CA 122.618 2.212 . . . . 0.0 113.613 175.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 29' ' ' LYS . 1.6 m -64.59 -54.06 38.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -165.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.443 ' CD1' ' CD2' ' A' ' 23' ' ' TRP . 0.7 OUTLIER -62.73 90.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.374 -166.088 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.0 OUTLIER -140.74 152.03 44.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.414 -171.355 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -64.27 128.66 36.77 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.293 171.866 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 6.3 tp10 -95.7 35.25 1.39 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.199 171.859 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.47 -52.08 0.7 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.9 p -109.77 -17.57 13.64 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.17 -178.247 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.26 33.43 44.46 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.68 137.11 32.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.275 -0.462 . . . . 0.0 110.414 171.492 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.2 m -66.45 137.3 56.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.309 167.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.473 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 28.4 mt -100.05 149.95 22.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.394 -167.304 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -89.62 -162.42 0.88 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.63 -173.288 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -95.71 36.69 1.26 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.355 -174.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.2 57.83 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 164.486 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.68 12.97 4.52 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 166.37 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -111.66 -169.01 1.38 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 114.621 -0.789 . . . . 0.0 110.657 178.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HA ' HD23 ' A' ' 19' ' ' LEU . . . -169.55 159.39 8.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.995 164.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HG2' HD22 ' A' ' 19' ' ' LEU . 16.7 pt-20 -113.96 132.99 55.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.009 -161.677 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.498 ' CE1' ' CD1' ' A' ' 56' ' ' TYR . 0.7 OUTLIER -90.41 74.95 6.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.231 174.056 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 58.37 40.95 23.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.903 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.47 21.11 35.63 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.524 -1.03 . . . . 0.0 110.524 177.146 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.42 95.86 46.54 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-O 121.248 0.547 . . . . 0.0 109.794 168.294 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.456 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 9.3 Cg_endo -64.26 152.86 79.59 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 C-N-CA 122.577 2.185 . . . . 0.0 113.63 -167.49 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 90.9 m-85 -153.94 173.12 16.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.886 173.323 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 75.8 m -56.96 133.18 54.58 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.408 163.592 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -61.25 -35.28 76.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.075 163.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.458 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m-70 -153.02 167.32 13.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.25 163.05 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.458 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.2 Cg_endo -66.83 -21.4 7.77 Favored 'Cis proline' 0 N--CA 1.488 1.179 0 C-N-CA 122.394 -1.919 . . . . 0.0 112.807 -17.245 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.4 m -56.73 -48.79 76.98 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.282 -153.866 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.498 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 10.1 t80 -60.98 -49.76 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.505 -178.735 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.41 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 25.0 p -72.06 -19.15 61.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.461 -175.921 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.178 -167.356 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 113.516 0.545 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.96 134.39 44.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.419 -168.608 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 34.1 t -81.61 123.16 80.95 Favored Pre-proline 0 C--O 1.251 1.15 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.076 -165.304 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -63.8 -28.13 67.9 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 123.092 2.528 . . . . 0.0 113.25 169.852 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -70.61 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.415 -178.237 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -99.24 -26.08 14.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.716 -162.92 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.77 67.13 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.508 -167.58 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 6.9 tptp -125.51 -168.99 1.92 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.039 160.761 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -100.84 149.81 23.46 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.64 165.283 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 53.5 t -119.01 122.45 69.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.544 -163.518 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.498 ' HB3' ' HG3' ' A' ' 14' ' ' GLU . 26.9 t80 -88.36 152.09 22.16 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.387 -172.84 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.538 ' HA ' ' HG3' ' A' ' 15' ' ' ARG . 90.4 m-85 -58.44 -59.51 5.24 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.468 -154.077 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -13.98 59.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.653 -174.166 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.498 ' HG3' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -107.1 42.87 1.23 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.563 164.923 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.538 ' HG3' ' HA ' ' A' ' 12' ' ' PHE . 11.6 mtt85 -99.75 170.59 8.45 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.128 161.351 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.476 HG23 ' HB2' ' A' ' 23' ' ' TRP . 19.8 m -150.08 149.06 14.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.524 153.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -115.13 136.8 52.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.841 -167.624 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 t -178.57 126.89 0.11 Allowed 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.991 -165.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.529 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 mm? 59.39 19.15 7.44 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.74 -170.629 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.7 -24.46 30.77 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 166.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -105.11 158.3 16.67 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.033 -0.584 . . . . 0.0 110.159 178.009 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -91.48 176.88 6.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.259 -166.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.515 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 25.1 m95 -153.15 166.34 32.81 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 114.016 -1.447 . . . . 0.0 109.149 -176.42 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.6 m80 -83.04 136.93 34.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.588 168.347 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.445 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 6.9 mtp180 -60.88 -43.81 92.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.95 -172.404 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -59.51 -37.15 90.81 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.596 2.197 . . . . 0.0 113.638 172.515 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.3 m -69.22 -47.62 64.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.161 -167.08 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tp -60.6 86.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.391 -166.313 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.469 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.5 mtmm -145.46 142.17 29.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.367 -167.241 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -61.56 129.74 42.6 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.386 172.823 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -95.15 22.55 6.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.197 171.705 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -130.46 -35.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.464 -167.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.8 -17.78 5.78 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.342 171.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.46 41.45 51.79 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 177.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -109.11 136.97 47.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.437 172.384 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -61.04 148.37 40.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.472 177.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 93.2 mt -110.41 135.1 51.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.316 -168.012 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -93.46 -168.32 1.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.488 -167.091 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -60.66 -29.46 69.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.554 -164.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.82 62.03 0.1 Allowed Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -173.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.76 11.63 3.42 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.007 -0.596 . . . . 0.0 111.781 167.109 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 13.9 p80 -106.83 -169.45 1.55 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.823 -0.689 . . . . 0.0 110.711 178.887 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -149.51 -166.91 2.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.586 164.685 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.529 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 8.4 pt-20 -133.03 135.68 45.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.405 166.865 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -103.14 161.77 13.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 157.637 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -60.36 91.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.243 -159.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 136.91 -52.1 0.78 Allowed Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -174.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.0 144.52 35.51 Favored Pre-proline 0 C--O 1.242 0.695 0 CA-C-O 121.324 0.583 . . . . 0.0 109.939 -160.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.514 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -69.45 162.93 39.96 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.952 2.434 . . . . 0.0 113.675 169.527 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 94.2 m-85 -156.3 -170.76 3.46 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.913 166.274 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.1 m -58.0 130.47 46.69 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.755 -1.566 . . . . 0.0 110.117 163.666 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -60.64 -32.66 71.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.993 163.56 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 30.7 m-70 -158.65 162.77 26.02 Favored Pre-proline 0 CA--C 1.551 0.991 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.254 162.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.408 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -73.61 -18.76 16.74 Favored 'Cis proline' 0 C--N 1.354 0.838 0 C-N-CA 122.651 -1.812 . . . . 0.0 113.829 -11.365 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.6 m -58.84 -43.08 90.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.961 -154.757 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -61.22 -60.19 4.14 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.32 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 36.7 t -65.4 -24.12 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.45 -173.518 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.222 -166.847 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.965 0 N-CA-C 113.588 0.572 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.68 157.35 28.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.453 -169.658 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.8 t -84.08 118.07 70.32 Favored Pre-proline 0 C--O 1.25 1.106 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.166 -162.279 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -60.03 -21.88 67.06 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.625 2.217 . . . . 0.0 113.106 170.051 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.48 -74.3 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.343 -176.647 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.37 -20.82 19.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.665 -165.111 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.8 t0 72.24 56.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.453 -171.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -116.45 -167.86 1.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.999 160.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.49 149.35 26.28 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.259 163.274 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.514 HG21 ' NE2' ' A' ' 24' ' ' HIS . 44.3 t -110.2 111.2 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.636 -164.785 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -78.81 163.73 25.1 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.318 179.831 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -60.52 -63.53 1.27 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.724 -159.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.19 -10.95 60.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.785 -174.534 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.6 44.3 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.238 170.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.55 141.44 47.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.607 -177.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.435 ' CG1' ' HD3' ' A' ' 25' ' ' ARG . 11.5 m -136.8 117.47 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.283 151.596 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -88.82 133.07 34.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.249 -175.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.7 121.37 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.435 -159.661 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.514 HD22 ' HG3' ' A' ' 44' ' ' GLU . 5.5 mp 59.87 27.12 16.41 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.8 166.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.03 19.17 29.44 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 162.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' NZ ' ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -171.09 154.57 4.12 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 164.694 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.7 OUTLIER -80.15 176.68 9.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.261 -163.562 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' NE1' ' HB2' ' A' ' 18' ' ' SER . 38.1 m95 -151.86 -176.12 5.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.353 -176.812 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.6 m80 -100.75 146.7 26.91 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.479 171.489 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.538 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.8 tpp85 -63.53 -47.31 83.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.831 -169.524 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.538 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -62.95 -31.45 77.07 Favored 'Trans proline' 0 N--CA 1.483 0.912 0 C-N-CA 122.525 2.15 . . . . 0.0 113.612 175.661 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -70.1 -43.94 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.188 -165.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.426 HD21 HG23 ' A' ' 16' ' ' VAL . 5.5 tp -69.04 77.59 0.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.27 -164.253 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 4.7 mtmt -137.44 149.65 47.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.412 -166.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -69.76 127.55 33.33 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.45 -178.517 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.65 18.35 20.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.712 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.421 ' HG3' ' HB3' ' A' ' 55' ' ' CYS . 19.4 mmmt -101.3 -60.16 1.57 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.356 162.215 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.3 p -103.65 -35.9 8.09 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 -167.538 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.28 49.73 3.18 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 179.149 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.47 ' HE3' ' CD2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -105.25 142.0 35.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.389 160.817 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.512 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 90.4 m -69.08 151.96 45.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.262 167.059 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.1 mt -116.94 156.92 26.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.26 -169.535 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -104.28 -168.21 1.46 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.627 -173.375 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.0 p -60.85 -26.38 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.547 -166.121 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.22 65.98 0.12 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -172.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.78 16.61 2.41 Favored Glycine 0 CA--C 1.521 0.443 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 168.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 10.3 p80 -111.93 -169.35 1.45 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.632 -177.286 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -144.24 -164.0 1.8 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.557 165.364 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.528 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -167.05 157.27 11.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.307 163.062 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.438 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 33.6 p80 -134.08 123.34 24.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.321 162.854 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 58.32 37.68 25.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.906 -178.841 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.09 23.15 69.51 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 165.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.64 99.95 25.92 Favored Pre-proline 0 C--O 1.244 0.784 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 168.672 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.8 Cg_endo -67.69 168.28 18.83 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.524 2.149 . . . . 0.0 113.614 -172.385 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -152.98 -165.04 2.08 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.075 166.252 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.1 m -56.85 131.12 48.53 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.141 -1.39 . . . . 0.0 110.258 161.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -33.08 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.845 160.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.45 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 27.5 m-70 -156.66 163.68 24.18 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.23 163.591 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.448 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.85 -17.63 18.09 Favored 'Cis proline' 0 N--CA 1.481 0.757 0 C-N-CA 122.705 -1.79 . . . . 0.0 113.631 -12.019 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.3 m -59.35 -44.03 92.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.796 -155.778 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.98 -54.39 45.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.467 178.161 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -72.7 -35.24 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.323 -169.296 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.36 -177.086 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . 0.472 ' HD2' ' HD3' ' A' ' 21' ' ' LYS . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.076 0 N-CA-C 113.486 0.533 . . . . 0.0 113.486 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -126.22 159.61 32.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.409 -171.225 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -86.08 119.27 71.62 Favored Pre-proline 0 C--O 1.249 1.046 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.199 -167.228 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -59.4 -23.75 71.67 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.655 2.237 . . . . 0.0 113.19 169.552 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -73.21 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.409 -178.53 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -97.69 -21.59 16.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.712 -161.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 73.42 67.18 0.1 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.559 -170.404 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.13 -171.19 2.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.102 159.618 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -102.22 154.94 18.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.757 166.232 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.512 HG21 ' NE2' ' A' ' 24' ' ' HIS . 59.1 t -124.19 112.03 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.828 -160.845 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.533 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.3 t80 -73.83 164.79 26.17 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.376 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -60.74 -56.93 15.32 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.798 -160.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.93 59.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.438 -1.255 . . . . 0.0 111.621 -174.311 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.533 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 6.3 pt-20 -111.2 37.81 2.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.965 163.921 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HA ' ' CG1' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -119.33 131.23 55.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.039 164.135 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 29.1 m -109.58 178.51 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.525 156.718 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.67 142.61 51.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.662 -176.461 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.6 t -177.77 136.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.376 170.545 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.467 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.2 mm? 60.08 29.12 18.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.593 -173.481 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.41 18.15 73.19 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 168.259 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HD3' ' HD2' ' A' ' 1' ' ' PRO . 9.0 mmtp -142.86 150.97 40.57 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 164.52 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -81.3 178.33 8.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.314 -164.102 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 27.3 m95 -151.08 160.18 44.05 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.4 -179.347 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 38.5 m80 -78.19 136.21 37.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.365 166.27 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.515 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.79 -43.86 93.19 Favored Pre-proline 0 CA--C 1.545 0.763 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.786 -170.87 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 5.0 Cg_endo -64.07 -23.79 67.04 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.351 2.034 . . . . 0.0 113.604 175.71 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.38 -45.62 21.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.313 -173.086 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.23 91.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.907 . . . . 0.0 110.346 -170.19 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 5.1 mtmt -152.6 141.56 21.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.385 -167.591 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -61.79 126.26 26.73 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.471 171.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 13.4 tp10 -97.21 20.32 11.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 170.942 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.525 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -107.36 -62.34 1.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.189 165.86 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.6 p -102.46 -19.17 15.02 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.776 -168.39 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.39 34.92 30.96 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.306 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -88.83 126.9 35.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.307 169.524 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.533 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 94.4 m -60.91 135.6 57.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.211 163.831 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 81.2 mt -99.49 104.43 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.387 -163.528 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -111.1 -168.63 1.33 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.395 -169.123 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 40.5 t 58.63 -89.02 0.02 OUTLIER 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.731 162.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.96 47.32 0.07 OUTLIER Glycine 0 CA--C 1.529 0.931 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 159.35 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -116.28 20.2 12.72 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -163.175 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.2 p80 -101.4 -169.57 1.71 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.916 -0.642 . . . . 0.0 110.711 177.011 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -175.41 159.51 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.14 167.803 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.467 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -117.62 137.45 52.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.068 -162.495 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -117.81 116.12 26.36 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 158.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.425 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 1.4 mt-10 60.74 -148.04 0.44 Allowed 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.439 -151.343 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -95.56 36.36 3.86 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 165.686 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.425 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -109.55 88.33 6.19 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-O 121.241 0.544 . . . . 0.0 109.786 171.757 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.3 Cg_endo -65.89 154.2 74.93 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.493 2.128 . . . . 0.0 113.58 -176.496 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.8 m-85 -148.16 -165.81 2.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.795 164.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 80.5 m -59.22 135.82 57.76 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.938 161.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -60.33 -34.72 74.22 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.254 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.9 m-70 -156.09 172.85 5.52 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.313 164.162 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.524 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.0 Cg_endo -63.35 -18.02 5.2 Favored 'Cis proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.431 -2.32 . . . . 0.0 112.533 -22.263 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.8 m -57.19 -45.2 83.93 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.221 -154.644 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -60.88 -49.03 79.11 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.317 -174.328 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -42.24 77.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.495 178.145 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 -170.216 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.72 150.77 51.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.391 -168.958 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.512 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.4 t -84.47 117.6 69.11 Favored Pre-proline 0 C--O 1.25 1.127 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.253 -164.201 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.16 -20.08 66.33 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 C-N-CA 122.784 2.322 . . . . 0.0 113.254 170.056 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.516 ' HG3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -78.97 -73.48 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.464 -177.543 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.61 -21.98 18.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.527 -164.487 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 72.55 64.56 0.12 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.501 -169.061 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -125.38 -168.58 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.083 161.465 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.66 151.63 23.46 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.592 161.922 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.516 HG21 ' NE2' ' A' ' 24' ' ' HIS . 33.9 t -112.21 112.57 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.494 -161.296 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.78 151.43 35.98 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.251 179.381 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -60.22 -49.38 77.86 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.007 -158.398 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.3 -0.78 33.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.472 -167.487 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -104.24 4.39 33.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 174.378 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.57 152.88 33.77 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.312 -160.811 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.404 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 21.7 m -150.29 136.8 12.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.754 159.116 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.9 m -113.19 135.11 54.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.505 -165.603 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 t -178.01 136.01 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.536 -165.692 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 60.14 21.64 10.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.593 -174.42 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 16.89 79.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 169.407 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 158.84 43.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 163.15 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.06 176.84 7.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.249 -164.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 30.9 m95 -150.13 179.94 7.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 113.983 -1.462 . . . . 0.0 109.227 -179.275 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.516 ' NE2' HG21 ' A' ' 10' ' ' VAL . 41.8 m80 -96.03 150.88 19.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.425 166.559 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.536 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -61.48 -58.91 15.42 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.875 178.336 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 13.3 Cg_endo -54.28 -22.79 27.62 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 122.188 1.925 . . . . 0.0 113.619 -177.426 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.516 ' HB3' ' HG3' ' A' ' 5' ' ' LYS . 8.0 m -81.45 -53.97 5.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.382 -172.247 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.71 93.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.482 -161.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -142.49 146.67 34.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.408 -176.79 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -60.09 126.51 27.82 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.541 174.287 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.506 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 1.2 tt0 -94.75 27.7 2.97 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.104 172.116 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.539 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -124.19 -55.8 1.66 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.468 173.668 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.9 p -107.4 -21.8 12.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.832 -172.546 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.96 51.42 23.97 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -171.348 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 tptm -98.05 123.47 42.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.14 163.566 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.4 m -61.43 133.46 55.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.118 170.096 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' A' ' 37' ' ' LEU . 94.8 mt -98.2 138.03 36.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.426 -161.733 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 150.28 31.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.268 165.406 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.0 t -64.84 65.9 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.63 162.204 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.69 150.04 5.54 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.527 -164.536 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.82 14.74 82.05 Favored Glycine 0 C--N 1.344 0.986 0 C-N-CA 119.934 -1.127 . . . . 0.0 111.37 171.926 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.401 ' HB2' HD11 ' A' ' 37' ' ' LEU . 8.3 p80 -120.11 -167.03 1.37 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 113.993 -1.104 . . . . 0.0 110.809 175.141 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -156.66 -165.63 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.899 -173.442 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.4 172.76 5.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.99 164.206 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.474 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 34.4 p80 -130.83 104.73 7.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.353 162.406 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 58.45 42.8 20.56 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.884 177.023 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 110.67 -18.91 26.65 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 166.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -98.73 101.11 11.01 Favored Pre-proline 0 C--O 1.243 0.752 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 -170.934 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 10.6 Cg_endo -65.82 157.99 56.08 Favored 'Trans proline' 0 N--CA 1.487 1.109 0 C-N-CA 122.472 2.115 . . . . 0.0 113.533 -171.059 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 62.8 m-85 -152.45 -176.75 5.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.052 169.964 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 71.3 m -57.42 134.2 55.83 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.029 158.908 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -69.47 -29.5 67.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.761 160.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.9 m-70 -153.59 161.03 30.21 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.153 164.546 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.62 -16.79 18.45 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 122.685 -1.798 . . . . 0.0 113.675 -12.516 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -59.4 -53.45 58.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.752 -156.161 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -61.03 -48.1 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.5 178.762 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.1 p -65.53 -21.21 66.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.33 -176.762 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.16 -168.661 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.485 0.991 0 N-CA-C 113.503 0.54 . . . . 0.0 113.503 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -135.09 132.26 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.414 -175.191 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.9 t -80.68 121.69 81.44 Favored Pre-proline 0 C--O 1.251 1.134 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.029 -162.66 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -63.43 -27.13 70.63 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 C-N-CA 122.957 2.438 . . . . 0.0 113.311 174.256 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -73.3 0.25 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.288 -179.178 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.5 p -91.95 -22.86 19.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.748 -160.998 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.6 t0 72.39 67.74 0.13 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.482 -169.809 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 0.0 OUTLIER -127.17 -168.77 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.156 162.155 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 152.93 22.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.601 162.254 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.511 HG21 ' NE2' ' A' ' 24' ' ' HIS . 74.9 t -122.04 110.46 27.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.945 -163.765 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -73.32 162.54 29.23 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.423 -178.666 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.507 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.7 OUTLIER -60.97 -55.73 29.52 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.822 -161.594 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.48 -9.25 59.57 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.579 -174.195 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.52 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 2.2 mt-10 -112.49 35.79 3.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.129 163.38 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -119.08 136.39 54.17 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.097 165.253 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 m -123.76 135.56 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.514 156.42 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 3.4 m -103.57 138.43 40.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.485 -170.685 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.1 t -170.39 131.39 0.94 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.383 -166.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.462 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.8 mm? 59.99 17.58 6.79 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.571 -173.355 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.81 -25.37 22.82 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 165.35 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 148.52 43.62 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.773 -0.714 . . . . 0.0 110.232 -178.27 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -81.78 177.6 8.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.17 -164.071 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.9 m95 -151.09 163.81 37.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.048 -1.433 . . . . 0.0 109.377 -177.147 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.2 m80 -84.6 140.11 31.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.593 170.426 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HG2' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -61.26 -44.21 92.55 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.961 -167.524 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_exo -51.96 -47.73 25.11 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.752 2.301 . . . . 0.0 113.424 166.446 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 m -63.95 -46.01 86.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.467 -165.717 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.443 ' CD1' ' CE1' ' A' ' 42' ' ' HIS . 1.6 tp -62.4 92.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -169.993 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -143.3 140.08 30.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.392 -170.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 10.7 t -60.23 129.11 40.07 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.448 171.363 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -98.81 39.78 1.24 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.095 -1.412 . . . . 0.0 110.242 172.458 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -143.23 -43.8 0.29 Allowed 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.362 -175.674 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.2 p -115.25 -19.05 10.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.006 173.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.84 41.78 54.9 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 179.41 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.411 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.86 133.56 44.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.315 169.667 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.2 m -60.74 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.299 168.461 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 42' ' ' HIS . 96.5 mt -97.9 132.62 43.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.308 -164.82 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -106.03 -168.67 1.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.524 -166.246 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.6 t -60.91 89.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.433 -165.067 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.57 55.45 20.34 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 163.825 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.5 21.55 2.73 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 164.537 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.531 ' HB2' HD11 ' A' ' 37' ' ' LEU . 9.7 p80 -115.17 -166.9 1.16 Allowed 'General case' 0 CA--C 1.524 -0.057 0 CA-C-N 114.92 -0.64 . . . . 0.0 110.581 -176.747 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.4 -164.46 1.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.706 -169.452 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.4 148.89 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.177 163.065 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.514 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 9.1 p80 -91.13 165.35 13.54 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.458 157.051 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.68 87.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.1 -167.832 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 145.16 -61.5 0.49 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.581 -1.007 . . . . 0.0 110.581 -169.149 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -135.33 142.34 41.13 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-O 121.693 0.758 . . . . 0.0 109.78 -162.108 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.521 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 13.6 Cg_endo -72.42 158.31 51.56 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.865 2.377 . . . . 0.0 113.757 173.697 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 34.2 m-85 -147.0 178.01 8.69 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.946 168.74 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -56.44 140.44 45.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.474 163.25 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -60.66 -34.26 74.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.111 165.202 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.8 m-70 -162.63 166.42 13.73 Favored Pre-proline 0 CA--C 1.552 1.019 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.331 165.556 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.509 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -71.91 -13.15 16.54 Favored 'Cis proline' 0 C--N 1.353 0.774 0 C-N-CA 122.745 -1.773 . . . . 0.0 113.569 -12.7 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.8 m -59.82 -41.26 90.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.68 -157.286 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -61.06 -38.2 85.36 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.367 176.856 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.519 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -75.77 -18.19 59.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.464 176.503 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.143 -168.79 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . 0.461 ' CD ' ' HE2' ' A' ' 21' ' ' LYS . 5.6 Cg_endo . . . . . 0 N--CA 1.486 1.03 0 N-CA-C 113.562 0.562 . . . . 0.0 113.562 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 28.9 mttp -133.53 156.63 47.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.455 170.591 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.3 t -86.1 123.28 72.0 Favored Pre-proline 0 C--O 1.25 1.128 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.167 -164.355 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.514 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -62.65 -30.31 78.68 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.808 2.338 . . . . 0.0 113.164 169.424 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -69.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.495 -175.313 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -98.33 -22.58 16.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 -165.178 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.9 59.68 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.52 -171.543 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.466 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -124.59 -172.06 2.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.142 159.2 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.448 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -100.76 153.1 19.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.7 168.803 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 53.9 t -118.12 113.46 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.74 -164.261 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.513 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 34.9 p90 -82.17 163.88 21.64 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.359 -178.095 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.534 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 m-85 -58.12 -59.5 5.2 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.26 -153.288 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.35 -11.24 59.81 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.698 -174.615 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.513 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 14.4 mt-10 -108.2 46.2 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.807 164.32 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -118.59 141.34 48.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.699 161.91 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -136.81 131.52 47.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.712 157.695 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 34.3 m -97.98 144.19 27.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.481 -164.531 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.627 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 23.8 t -171.39 130.11 0.72 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.43 -171.035 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.481 HD23 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.17 15.08 4.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.698 -168.577 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.19 -24.58 31.57 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 170.661 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.461 ' HE2' ' CD ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -110.98 140.31 45.6 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 114.806 -0.697 . . . . 0.0 110.091 -178.897 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.54 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 5.6 m-20 -77.77 177.92 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.212 -161.299 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.514 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 31.7 m95 -150.59 171.15 17.56 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 113.82 -1.536 . . . . 0.0 109.279 179.739 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.519 ' NE2' HG21 ' A' ' 10' ' ' VAL . 44.4 m80 -88.75 149.14 23.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.506 174.925 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.527 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 tpp180 -61.32 -45.73 95.01 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.876 -170.975 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -64.24 -34.89 54.54 Favored 'Trans proline' 0 N--CA 1.484 0.956 0 C-N-CA 122.582 2.188 . . . . 0.0 113.601 174.378 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.31 -47.4 61.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.216 -164.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.518 HD22 ' CD2' ' A' ' 42' ' ' HIS . 2.5 tp -61.72 83.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.296 -168.444 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.509 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -144.88 152.0 39.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.442 -165.567 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -70.05 138.67 52.3 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.459 -177.777 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.494 ' HG3' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -89.65 -23.31 21.93 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.735 174.555 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -71.08 -64.63 0.87 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.957 172.81 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.1 p -108.47 -19.79 13.33 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.965 -159.493 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.73 42.82 53.1 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 177.627 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.522 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -100.19 136.52 39.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.346 166.3 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 m -60.69 146.19 46.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.323 170.891 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 96.5 mt -110.38 153.05 25.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.288 -163.231 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 m -105.83 170.29 7.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.452 -163.569 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 t -61.64 -17.67 56.31 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.459 -168.344 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.91 57.19 0.14 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.97 11.61 3.63 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 114.917 -0.642 . . . . 0.0 111.753 166.889 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.627 ' HE1' ' OG ' ' A' ' 18' ' ' SER . 27.6 p80 -111.11 -169.8 1.52 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.144 0.497 . . . . 0.0 111.007 -177.662 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -154.24 -165.14 2.01 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.871 167.949 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.507 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -171.84 158.41 4.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.126 171.516 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -123.2 172.76 8.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.957 157.947 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -61.42 91.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.192 -163.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.65 -65.77 0.34 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -169.181 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HD2' ' CE2' ' A' ' 50' ' ' TYR . 2.6 pttp -152.89 138.98 12.07 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-O 121.91 0.862 . . . . 0.0 109.961 -163.501 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 20.5 Cg_endo -69.28 170.01 16.98 Favored 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.934 2.422 . . . . 0.0 113.572 170.127 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -153.64 -164.99 2.02 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.908 162.859 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 89.0 m -57.19 136.82 56.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.259 159.973 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -31.93 71.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.938 163.606 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.514 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.9 m-70 -161.51 165.99 15.62 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.305 165.466 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -72.03 -14.25 16.56 Favored 'Cis proline' 0 N--CA 1.482 0.8 0 C-N-CA 122.557 -1.851 . . . . 0.0 113.582 -13.934 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.0 m -59.81 -42.3 93.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.682 -157.11 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -61.0 -39.25 88.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.53 176.083 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 15.9 t -84.54 -12.42 54.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -173.901 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.32 175.906 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 141.02 46.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.388 -168.734 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.9 t -82.25 117.02 66.92 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.164 -163.917 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.83 -21.92 72.06 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.727 2.285 . . . . 0.0 113.216 170.049 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? -76.42 -71.1 0.41 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.482 -175.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.64 -22.72 16.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.582 -164.991 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.47 55.49 0.15 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.503 -171.38 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -117.5 -169.25 1.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.948 159.771 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.94 148.43 25.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.65 167.096 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 50.7 t -109.7 111.09 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.651 -167.053 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 34.7 t80 -74.79 159.03 32.47 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.306 178.01 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.463 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 6.7 m-85 -60.58 -62.38 1.9 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.75 -160.118 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -1.72 11.63 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.72 -173.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -102.27 14.06 32.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.379 178.625 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -96.6 151.41 19.63 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.33 -161.496 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.453 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.0 m -143.9 145.02 22.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.601 156.19 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.1 m -115.71 136.26 53.23 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.715 -166.965 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 t -178.43 128.69 0.12 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.195 -169.316 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.534 ' HG ' ' HB3' ' A' ' 44' ' ' GLU . 2.5 mm? 60.12 34.97 21.23 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.605 -172.479 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.46 18.13 60.68 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 168.119 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -141.4 155.3 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 165.284 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.95 176.58 6.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.403 -165.822 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 26.2 m95 -149.8 -177.88 6.14 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.24 -177.079 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.519 ' NE2' HG21 ' A' ' 10' ' ' VAL . 42.9 m80 -99.2 145.97 26.66 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.553 168.928 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.468 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.1 mtp180 -61.22 -48.65 91.05 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.726 -168.899 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -64.0 -34.8 57.68 Favored 'Trans proline' 0 N--CA 1.483 0.87 0 C-N-CA 122.492 2.128 . . . . 0.0 113.647 177.049 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.01 -45.39 89.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.338 -166.131 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.413 HD21 HG22 ' A' ' 16' ' ' VAL . 9.6 tp -60.41 93.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.316 -162.173 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.406 ' N ' HD13 ' A' ' 37' ' ' LEU . 2.2 mttt -141.02 153.58 45.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.331 -164.268 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -73.35 126.4 30.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.403 173.27 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.466 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 19.3 mt-10 -96.09 33.46 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.046 168.509 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.461 ' CE ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -128.05 -52.8 1.31 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.077 175.619 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.21 -18.81 13.21 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.018 -177.462 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.12 36.42 40.63 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.384 -1.086 . . . . 0.0 110.384 175.762 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -100.39 137.0 39.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.476 170.38 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -66.96 147.96 52.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.433 170.315 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 6.9 mt -113.08 154.25 26.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.269 -169.939 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.2 m -154.28 158.24 39.9 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.128 -160.597 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m 60.59 11.96 3.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.122 171.519 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 59.19 54.45 37.81 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.201 -1.159 . . . . 0.0 110.201 -159.406 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.82 6.61 83.5 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 114.634 -0.783 . . . . 0.0 111.959 177.675 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.538 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.6 p80 -107.07 -172.18 2.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.38 -166.195 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.88 -163.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.813 163.897 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.536 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.8 tt0 -147.86 133.85 19.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.258 176.497 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.14 125.28 26.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 162.936 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.516 ' HB3' ' HG2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER 60.27 -150.19 0.42 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 -152.753 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -96.0 32.46 6.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 166.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HG2' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -117.84 99.16 52.1 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-O 121.702 0.763 . . . . 0.0 109.799 170.724 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.536 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.0 Cg_endo -58.81 165.34 8.36 Favored 'Trans proline' 0 N--CA 1.486 1.04 0 C-N-CA 122.161 1.907 . . . . 0.0 113.649 173.302 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 81.1 m-85 -153.73 -165.46 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.072 171.311 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.524 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 72.4 m -57.45 133.21 55.0 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.351 162.543 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -60.7 -31.01 70.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.926 161.469 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.1 m-70 -159.4 162.24 25.94 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.115 163.858 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -74.28 -17.42 18.95 Favored 'Cis proline' 0 N--CA 1.482 0.805 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.552 -14.093 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.524 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.19 -37.05 76.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.796 -155.311 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -62.49 -60.63 3.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.384 172.079 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 1.6 m -71.74 -17.19 62.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.414 -166.2 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.334 171.651 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.486 1.064 0 N-CA-C 113.554 0.559 . . . . 0.0 113.554 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.511 ' HG2' ' NZ ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -144.36 144.31 31.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.375 169.635 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -87.79 118.89 70.28 Favored Pre-proline 0 C--O 1.251 1.136 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.135 -164.56 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -60.97 -27.15 84.35 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.712 2.275 . . . . 0.0 113.211 169.108 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -69.78 0.36 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.459 -173.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -96.59 -22.07 17.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.621 -166.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.05 53.73 0.19 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.45 -171.238 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 -167.91 1.25 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.001 160.674 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.48 149.09 26.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.269 162.803 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG23 ' CD2' ' A' ' 24' ' ' HIS . 52.0 t -109.62 111.15 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.667 -166.502 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.537 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.6 t80 -78.84 161.76 26.54 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.282 178.117 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.68 -62.64 1.73 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.966 -157.723 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -10.83 60.16 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.779 -173.681 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.537 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.8 pt-20 -103.04 43.09 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.189 171.15 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -111.84 147.31 36.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.548 -177.45 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -140.43 143.15 29.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.459 154.188 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.9 m -115.61 133.82 55.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.616 -166.617 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.1 t -178.3 136.68 0.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.333 -171.4 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.463 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 2.7 mm? 59.97 29.43 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.65 -172.992 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.23 17.33 70.06 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 167.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.511 ' NZ ' ' HG2' ' A' ' 2' ' ' LYS . 1.2 tttm -143.64 160.13 41.22 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 164.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.02 177.34 6.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.306 -165.686 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 27.6 m95 -151.94 -174.94 5.03 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.116 -178.84 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.8 m80 -101.4 146.99 26.87 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.543 169.546 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 51.1 ttp180 -60.98 -47.14 96.35 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.727 -168.75 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -63.43 -35.36 61.47 Favored 'Trans proline' 0 N--CA 1.484 0.936 0 C-N-CA 122.55 2.166 . . . . 0.0 113.576 175.483 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -67.1 -50.81 60.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.328 -163.236 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.37 89.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.339 -163.674 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.3 ttmm -147.57 141.96 26.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.321 -164.95 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.5 t -60.83 119.71 8.73 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.283 165.627 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -96.91 27.2 4.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.962 168.02 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.73 -55.71 2.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.092 169.165 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.3 p -106.96 -24.52 11.98 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.652 -174.351 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.79 45.3 7.3 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -177.436 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.24 124.87 46.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.304 168.137 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 m -61.0 139.48 58.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.269 168.109 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 75.0 mt -103.39 127.03 50.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.273 -165.371 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -69.57 -170.21 0.28 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.565 169.603 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -105.14 18.15 22.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.6 -168.474 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.62 58.71 0.09 OUTLIER Glycine 0 CA--C 1.531 1.048 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 162.334 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.25 10.98 1.56 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.88 168.446 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.533 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 14.6 p80 -113.4 -169.09 1.43 Allowed 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.415 -0.392 . . . . 0.0 110.868 -175.913 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.521 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -154.08 -164.17 1.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.909 168.201 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.3 pp20? -164.08 139.52 6.11 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.085 170.638 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.421 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 57.0 t60 -95.3 161.99 13.86 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.3 159.951 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 28.6 mm-40 -61.44 88.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.049 -166.364 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.18 -66.0 0.35 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.304 -1.119 . . . . 0.0 110.304 -167.059 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.14 141.91 19.09 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.422 0.63 . . . . 0.0 109.82 -163.445 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.48 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.7 Cg_endo -68.44 160.05 50.82 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.967 2.445 . . . . 0.0 113.734 169.552 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 60.8 m-85 -147.63 -163.35 1.75 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.568 164.426 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.2 m -56.94 138.36 54.13 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.265 159.078 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.521 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 34.6 t30 -60.73 -35.84 77.37 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.988 164.113 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.459 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 27.4 m-70 -157.85 165.14 19.3 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.227 164.423 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -73.07 -15.36 18.1 Favored 'Cis proline' 0 C--N 1.354 0.868 0 C-N-CA 122.512 -1.87 . . . . 0.0 113.595 -14.192 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.8 m -59.61 -39.42 84.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.619 -156.636 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -61.15 -56.99 14.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.351 171.919 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.459 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -65.66 -26.52 67.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.399 -169.418 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.321 -169.896 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo . . . . . 0 N--CA 1.486 1.044 0 N-CA-C 113.617 0.583 . . . . 0.0 113.617 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -143.9 152.83 41.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.461 -167.063 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -89.99 118.01 68.55 Favored Pre-proline 0 C--O 1.249 1.043 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.177 -165.657 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -57.89 -26.82 76.05 Favored 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.61 2.207 . . . . 0.0 113.175 168.933 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -73.41 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.417 -174.885 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -93.87 -21.8 19.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 -165.683 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 t0 72.59 58.63 0.13 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.526 -172.601 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.517 ' NZ ' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -119.74 -168.96 1.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.027 159.452 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.444 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 3.7 mt-10 -102.71 154.03 19.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.696 162.851 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG23 ' CD2' ' A' ' 24' ' ' HIS . 37.1 t -113.5 114.06 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.452 -162.85 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.62 154.79 41.51 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.365 177.125 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.65 -62.24 2.0 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.847 -159.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.44 -1.22 10.12 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.648 -173.399 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -102.57 14.09 32.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.466 178.315 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 153.27 17.97 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 -160.815 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.462 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.1 m -145.11 151.15 15.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.699 155.703 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -115.41 136.23 53.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.724 -168.726 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.502 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 23.1 t -177.84 135.75 0.18 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.279 -177.923 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.428 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 2.3 mm? 60.04 28.41 17.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -169.844 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.27 18.21 64.86 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 170.22 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -138.05 153.85 49.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 164.893 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.87 176.35 7.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.412 -165.973 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 29.4 m95 -147.52 -177.99 6.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.134 -176.907 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.521 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.3 m80 -100.96 141.36 33.96 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.965 -1.471 . . . . 0.0 110.526 167.691 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.517 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.35 84.97 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.827 -168.251 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -58.5 -35.65 98.4 Favored 'Trans proline' 0 N--CA 1.483 0.905 0 C-N-CA 122.608 2.205 . . . . 0.0 113.538 174.78 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.91 -43.5 98.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.114 -168.832 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.445 ' CD1' ' CE1' ' A' ' 42' ' ' HIS . 11.9 tp -63.29 86.62 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.455 -160.442 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -131.51 148.74 52.66 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.247 -167.982 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -75.22 129.41 37.42 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.345 172.322 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -98.05 41.87 1.11 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.163 166.581 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.457 ' CE ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -143.55 -40.79 0.3 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.466 -176.949 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.06 -12.61 9.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.332 173.579 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.9 42.45 99.65 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -124.24 136.89 54.49 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 164.332 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 29' ' ' LYS . 2.7 t -61.37 -170.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.242 -169.142 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.0 mt -143.1 150.96 40.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.478 -163.671 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.05 -171.99 3.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.294 -164.019 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.6 p -64.39 77.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.323 166.12 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 53.96 9.42 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 178.642 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.59 12.93 10.96 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.469 -0.653 . . . . 0.0 111.469 165.791 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.8 p80 -102.56 -168.79 1.57 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.579 -0.81 . . . . 0.0 110.528 175.933 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.18 158.62 14.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.889 161.304 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -113.13 127.3 56.16 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.982 -163.2 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.493 ' CD2' ' HG3' ' A' ' 46' ' ' GLU . 86.3 t60 -121.48 130.24 53.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.675 160.279 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.493 ' HG3' ' CD2' ' A' ' 45' ' ' HIS . 3.2 mm-40 58.27 34.73 24.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.074 171.698 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 36.65 70.65 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 171.642 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.06 128.2 9.18 Favored Pre-proline 0 C--O 1.242 0.667 0 CA-C-O 121.655 0.741 . . . . 0.0 109.612 162.358 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -63.59 159.9 38.65 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 C-N-CA 122.567 2.178 . . . . 0.0 113.57 174.45 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 72.9 m-85 -151.47 -174.11 4.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.758 165.761 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.8 m -57.63 123.56 16.04 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 113.569 -1.65 . . . . 0.0 110.229 164.362 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -60.73 -28.65 68.84 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.11 -1.404 . . . . 0.0 109.931 165.095 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 22.3 m-70 -155.89 160.27 30.93 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.862 -1.063 . . . . 0.0 108.982 159.255 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -74.57 -20.24 16.26 Favored 'Cis proline' 0 C--N 1.354 0.839 0 C-N-CA 122.803 -1.749 . . . . 0.0 113.699 -11.994 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.9 m -58.91 -56.1 26.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.808 -155.449 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 45' ' ' HIS . 7.0 t80 -61.06 -45.33 95.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.293 -179.772 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.431 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 17.2 t -61.02 -15.4 31.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.547 175.407 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.184 -173.21 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.429 0.511 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.49 133.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.439 169.24 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.507 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.7 t -89.58 133.04 35.21 Favored Pre-proline 0 C--O 1.243 0.753 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.166 -165.36 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 6.3 Cg_exo -73.06 -26.78 14.67 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.246 2.631 . . . . 0.0 113.44 171.533 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 -64.41 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.297 -164.712 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -92.5 -28.9 16.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.371 -164.792 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 73.72 58.79 0.09 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.525 -165.832 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.83 -168.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.838 158.245 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -108.82 149.57 28.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.624 160.772 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.52 HG23 ' CD2' ' A' ' 24' ' ' HIS . 65.5 t -103.5 117.89 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.595 -167.662 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -91.88 55.12 2.59 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.951 -156.072 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 61.59 -79.09 0.02 OUTLIER 'General case' 0 C--N 1.34 0.155 0 CA-C-N 113.976 -1.466 . . . . 0.0 110.358 178.477 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.18 -2.12 36.11 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.512 -163.068 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.69 13.96 30.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.251 176.682 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.414 ' NH1' ' HG3' ' A' ' 15' ' ' ARG . 14.3 ptt85 -83.78 153.48 24.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.258 -164.974 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.26 122.18 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.741 157.362 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 88.4 m -98.59 135.81 39.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.408 -162.197 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -178.0 137.39 0.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.586 -167.594 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.23 25.92 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.548 -173.039 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.58 -24.2 24.42 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 165.868 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -127.33 139.72 52.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 114.703 -0.749 . . . . 0.0 110.029 -177.251 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -68.86 -179.17 1.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.338 -161.394 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 60.3 m95 -145.77 -177.6 5.67 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 113.59 -1.641 . . . . 0.0 109.396 178.659 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.52 ' CD2' HG23 ' A' ' 10' ' ' VAL . 47.9 m80 -100.49 143.73 30.32 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.616 168.83 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.528 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 21.7 ttp85 -63.57 -53.22 53.28 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.81 179.13 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.7 Cg_endo -53.25 -13.41 3.22 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 122.459 2.106 . . . . 0.0 113.612 172.296 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -96.38 -64.26 1.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.328 -179.171 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.519 HD13 ' CE1' ' A' ' 42' ' ' HIS . 0.8 OUTLIER -64.85 91.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.398 -166.418 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.518 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.85 170.68 17.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.234 168.638 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.5 t -60.79 150.62 32.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.326 168.373 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.9 mm-40 -118.74 25.7 10.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.732 160.063 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.47 -59.99 1.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.172 167.902 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -102.3 -48.44 4.19 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.645 -167.759 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.42 56.45 0.51 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 167.284 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -131.01 137.52 49.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.39 167.386 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.4 m -60.73 153.16 24.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.442 174.02 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.5 mt -113.54 153.38 28.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.404 -165.424 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.459 HG23 ' N ' ' A' ' 39' ' ' SER . 93.8 m -68.72 166.58 17.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.475 -178.025 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.459 ' N ' HG23 ' A' ' 38' ' ' THR . 66.4 m -62.4 77.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.415 170.175 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.3 55.2 3.53 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 172.291 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.36 11.53 4.98 Favored Glycine 0 CA--C 1.522 0.519 0 CA-C-N 115.102 -0.549 . . . . 0.0 111.777 166.172 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 3.9 p80 -99.45 -169.26 1.73 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.84 -0.68 . . . . 0.0 110.47 177.49 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -130.91 171.65 12.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.339 168.91 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.76 138.35 23.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.05 -170.879 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -121.61 114.79 21.67 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.437 -0.801 . . . . 0.0 108.858 164.797 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.73 -148.11 0.44 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.522 -152.408 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -95.35 35.0 4.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 166.923 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm -107.37 87.55 3.36 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 121.211 0.529 . . . . 0.0 109.756 169.229 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.467 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.0 Cg_endo -62.85 147.9 94.09 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 122.526 2.151 . . . . 0.0 113.552 -174.847 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.5 m-85 -144.95 -165.78 2.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.922 162.095 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 99.5 m -59.11 -178.01 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.703 171.534 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.84 -32.89 11.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.178 164.586 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 42.2 m-70 -164.75 165.97 11.75 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.03 -0.987 . . . . 0.0 109.541 171.472 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 Cg_endo -69.61 -6.48 9.21 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.635 -1.819 . . . . 0.0 113.604 -11.515 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.5 m -60.28 -51.05 71.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.425 -162.001 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -60.73 -37.42 81.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.416 -168.136 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 60.1 p -86.91 -21.66 26.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.515 -173.817 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.358 -170.232 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.242 0 N-CA-C 113.369 0.488 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.539 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 2.1 ttmm 63.77 162.34 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.218 165.331 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.8 t -80.6 131.27 61.6 Favored Pre-proline 0 C--O 1.243 0.737 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.486 -163.256 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 5.2 Cg_exo -70.4 -9.11 25.17 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 123.223 2.616 . . . . 0.0 113.504 170.328 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -102.19 -72.55 0.68 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.332 -172.38 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -91.99 -21.85 20.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.524 -160.157 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 t0 73.63 61.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.507 -167.164 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.92 166.65 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.076 159.447 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.539 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -85.4 148.72 25.87 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.42 171.92 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.519 HG23 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -110.16 116.85 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.742 -160.341 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -168.39 1.17 Allowed 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -74.28 -84.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.509 -165.973 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.78 -10.39 58.2 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.193 -0.603 . . . . 0.0 111.713 -159.158 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -104.98 42.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.963 169.621 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.35 149.12 25.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.396 176.324 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 23' ' ' TRP . 18.5 m -148.85 144.71 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.065 162.05 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 m -114.99 135.85 53.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.378 -168.822 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.8 t -177.79 128.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.366 -168.859 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 44' ' ' GLU . 2.2 mm? 60.17 22.11 11.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.423 -170.77 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.4 -24.4 27.6 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 164.524 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -114.4 137.37 51.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 114.76 -0.72 . . . . 0.0 110.24 -177.192 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.67 178.51 5.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.32 -163.388 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.524 ' HB2' HG21 ' A' ' 16' ' ' VAL . 41.6 m95 -146.46 177.4 9.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.59 -177.311 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.519 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.7 m80 -98.21 137.55 36.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.463 169.501 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 10.1 ttp85 -60.8 -47.28 96.22 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.878 -170.702 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.6 Cg_exo -54.75 -35.77 88.71 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.576 2.184 . . . . 0.0 113.544 170.929 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.34 -54.2 13.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.317 -172.967 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.515 HD12 ' CE1' ' A' ' 42' ' ' HIS . 2.1 tp -62.67 96.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.322 -166.243 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HG3' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -139.82 177.88 7.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 166.863 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.4 t -61.37 170.33 1.83 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.114 164.553 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 1.8 pt-20 -140.45 20.85 2.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.652 160.08 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.518 ' HE2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -100.2 -57.65 2.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.271 167.577 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.62 -49.83 4.96 Favored 'General case' 0 CA--C 1.524 -0.05 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.525 -170.895 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.05 59.73 0.61 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 169.931 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.68 139.17 27.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.058 0.456 . . . . 0.0 110.457 166.857 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.526 HG21 ' HG3' ' A' ' 29' ' ' LYS . 1.8 m -61.49 171.62 1.42 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.437 -173.571 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.522 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 5.8 mt -129.05 -177.82 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.366 -170.858 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -109.31 -169.44 1.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.548 -170.154 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.5 t -61.32 -25.26 67.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.342 -170.059 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 173.37 70.52 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.79 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.57 10.7 8.53 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.615 -0.594 . . . . 0.0 111.615 166.134 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.515 ' CE1' HD12 ' A' ' 28' ' ' LEU . 6.1 p80 -90.63 -169.5 2.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.441 173.361 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.7 172.59 12.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.328 167.632 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 19' ' ' LEU . 0.4 OUTLIER -128.57 147.76 50.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.964 166.758 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.418 ' N ' ' HG2' ' A' ' 44' ' ' GLU . 86.0 t60 -84.27 -79.37 0.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.837 170.112 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -171.12 73.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.928 167.738 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 155.88 -45.75 0.52 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.545 -174.652 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 2.4 mptp? -143.98 138.61 15.2 Favored Pre-proline 0 C--O 1.242 0.665 0 CA-C-O 121.489 0.661 . . . . 0.0 109.87 -170.927 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.516 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 19.7 Cg_endo -64.18 147.15 91.33 Favored 'Trans proline' 0 N--CA 1.486 1.046 0 C-N-CA 122.658 2.238 . . . . 0.0 113.58 171.012 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.7 m-85 -139.49 -168.12 2.4 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.868 163.814 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 57.3 m -58.42 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.548 166.959 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -102.91 -30.26 10.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.132 161.876 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.514 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.3 m-70 -168.46 165.48 7.46 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.412 171.646 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.501 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -70.13 -5.76 9.63 Favored 'Cis proline' 0 N--CA 1.482 0.816 0 C-N-CA 122.576 -1.843 . . . . 0.0 113.741 -10.825 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.6 m -60.07 -41.33 92.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.554 -161.467 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.31 -39.59 94.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.381 -169.335 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -98.65 -19.34 17.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.328 -168.046 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.274 -167.811 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 113.574 0.567 . . . . 0.0 113.574 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 8.4 mmtt -138.87 139.86 38.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.467 -170.38 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.1 t -97.76 122.5 54.79 Favored Pre-proline 0 C--O 1.243 0.711 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.202 -165.329 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.513 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 8.3 Cg_endo -61.78 -27.64 80.92 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 122.538 2.159 . . . . 0.0 113.024 172.1 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.75 -55.43 3.57 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.666 -155.977 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -92.03 -27.61 17.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.395 -177.488 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.95 68.29 0.1 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.504 -165.484 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 -167.69 1.86 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.017 160.394 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -110.34 149.54 30.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.114 162.419 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 50.5 t -108.68 130.52 61.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.813 -161.553 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.46 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.8 t80 -90.67 178.43 6.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.359 -178.832 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -64.11 -83.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.281 -167.0 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.8 -1.95 10.74 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.554 -161.872 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -102.77 18.32 21.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.21 178.843 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -98.09 146.51 25.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.276 -165.358 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.468 HG23 ' CD2' ' A' ' 28' ' ' LEU . 14.5 m -143.3 120.92 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.891 156.515 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 33.3 m -90.31 132.29 35.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.383 -178.559 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.474 ' HB3' ' HA2' ' A' ' 40' ' ' GLY . 0.0 OUTLIER -167.94 124.32 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.155 -162.004 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.437 ' HA ' HD11 ' A' ' 19' ' ' LEU . 1.9 mm? 60.28 24.84 14.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.574 -173.528 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 99.13 -25.43 28.25 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 161.221 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -121.77 138.54 54.33 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.848 -0.676 . . . . 0.0 109.976 178.569 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -73.06 178.6 4.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.37 -160.489 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' A' ' 5' ' ' LYS . 63.3 m95 -143.52 177.5 8.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.802 -176.377 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.522 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.2 m80 -102.43 139.48 37.97 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.307 168.056 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.519 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 ttt180 -61.04 -51.27 80.3 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.779 -168.242 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 10.3 Cg_endo -56.82 -28.97 79.31 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.489 2.126 . . . . 0.0 113.518 173.036 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -67.31 -64.64 0.81 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.311 177.511 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.515 HD13 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -64.57 94.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 -163.444 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.19 173.28 9.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.227 167.516 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -60.63 -178.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.187 166.259 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -135.01 18.8 3.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.736 160.45 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.6 -45.39 1.48 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.536 -168.096 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -107.12 -32.13 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.75 176.057 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.85 64.39 1.49 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 177.382 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.1 tttp -150.15 145.83 26.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.038 -0.581 . . . . 0.0 110.422 -178.537 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.73 153.31 43.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.461 -174.707 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.517 HD11 ' ND1' ' A' ' 42' ' ' HIS . 14.4 mt -122.06 141.12 51.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.339 -168.179 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -175.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.442 -169.348 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.432 ' HA ' ' HB ' ' A' ' 16' ' ' VAL . 11.8 p -67.61 72.55 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.407 169.557 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.474 ' HA2' ' HB3' ' A' ' 18' ' ' SER . . . 72.25 57.72 5.49 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 172.13 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -125.53 12.15 7.47 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 164.315 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.517 ' ND1' HD11 ' A' ' 37' ' ' LEU . 2.8 p80 -102.0 -170.31 1.8 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 114.606 -0.797 . . . . 0.0 110.411 176.104 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -126.9 -174.35 3.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.34 169.902 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -164.94 146.26 7.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.971 -168.664 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -113.73 -51.34 2.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.755 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -171.15 99.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.101 165.9 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.25 12.66 32.35 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.649 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HG2' ' HG3' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -141.8 86.99 10.27 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 114.914 -0.643 . . . . 0.0 109.785 -175.632 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.1 Cg_endo -60.94 147.26 96.13 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.518 2.145 . . . . 0.0 113.608 -176.198 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 4.3 m-85 -135.51 -178.55 5.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.015 164.464 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.9 m -59.31 -178.42 0.06 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.652 172.331 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -97.37 -34.88 10.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.999 164.481 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.541 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.0 m-70 -154.73 173.94 4.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-O 122.135 0.969 . . . . 0.0 109.344 165.969 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.541 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.6 Cg_endo -62.29 -12.93 3.62 Favored 'Cis proline' 0 N--CA 1.498 1.743 0 C-N-CA 121.312 -2.37 . . . . 0.0 112.505 -20.699 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.4 m -58.15 -48.3 80.69 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.85 -158.628 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.76 -41.02 94.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.457 -168.81 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -77.76 -18.92 55.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.55 -176.911 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.215 -168.161 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.083 0 N-CA-C 113.418 0.507 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -148.23 165.51 30.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.388 -168.363 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.7 t -78.93 135.83 58.68 Favored Pre-proline 0 C--O 1.244 0.803 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.434 -162.489 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 4.6 Cg_exo -69.85 -26.39 27.19 Favored 'Trans proline' 0 N--CA 1.484 0.966 0 C-N-CA 123.437 2.758 . . . . 0.0 113.358 166.826 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.97 -65.85 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.365 -167.296 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -97.4 -25.84 15.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.577 -163.965 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.7 t70 72.77 69.7 0.13 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.504 -164.544 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.42 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 0.2 OUTLIER -129.6 -168.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.158 163.22 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.69 148.37 28.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.406 160.851 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 54.4 t -107.71 112.45 40.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.902 -165.919 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CZ ' ' A' ' 12' ' ' PHE . 17.7 t80 -66.95 160.91 25.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.354 176.342 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CZ ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -62.24 -76.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.221 -167.868 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.76 -0.31 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.45 -162.553 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -105.7 16.59 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.279 177.064 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.56 157.8 16.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.263 -166.148 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.507 HG21 ' HB2' ' A' ' 23' ' ' TRP . 18.2 m -147.89 123.09 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.82 160.393 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 84.9 m -100.62 135.28 42.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.443 -167.259 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 6.9 t -177.91 130.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.438 -166.061 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.537 ' HG ' ' HG3' ' A' ' 44' ' ' GLU . 2.4 mm? 60.04 37.69 21.03 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.663 -175.158 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.22 17.61 46.38 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 165.709 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -151.33 123.15 8.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.039 168.019 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.56 -179.34 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.351 -162.703 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 50.4 m95 -145.79 169.68 18.04 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.708 -178.077 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 46.2 m80 -92.85 144.02 25.69 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.52 170.245 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 ttp85 -61.16 -49.51 88.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 -169.833 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 2.9 Cg_exo -57.8 -33.68 97.23 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.692 2.261 . . . . 0.0 113.504 172.728 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.17 -55.81 8.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.28 -171.194 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.453 HD11 ' CG ' ' A' ' 23' ' ' TRP . 1.9 tp -60.7 87.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.345 -167.054 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.08 153.39 47.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.224 -170.874 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -65.6 171.38 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.441 164.688 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 38.6 tt0 -121.54 -21.64 6.16 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.707 173.322 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -94.7 -39.42 10.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.501 -167.53 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.9 p -105.98 -42.49 5.1 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.0 174.701 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.41 58.04 2.01 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 175.601 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.28 139.2 49.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.364 167.792 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 158.27 18.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.32 -176.645 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.6 mt -119.96 137.04 54.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.434 -166.235 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.474 HG23 ' N ' ' A' ' 39' ' ' SER . 39.4 m -67.61 169.76 8.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.523 -178.571 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.474 ' N ' HG23 ' A' ' 38' ' ' THR . 2.3 m -69.55 76.67 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.436 -175.27 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.28 56.64 1.44 Allowed Glycine 0 CA--C 1.529 0.918 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 169.633 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.8 10.72 3.68 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-N 114.908 -0.646 . . . . 0.0 111.824 166.972 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.516 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 2.8 p80 -103.54 -170.45 1.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.328 -177.102 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.452 ' HB1' ' ND2' ' A' ' 52' ' ' ASN . . . -132.51 -171.72 2.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.061 165.19 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.537 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -170.98 154.49 4.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.972 -172.624 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 14.4 p80 -105.86 -169.3 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.067 160.006 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -62.53 81.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.272 -177.424 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 124.18 -33.8 3.73 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 168.651 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.497 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.9 OUTLIER -124.51 109.1 28.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-O 121.574 0.702 . . . . 0.0 109.735 -165.199 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.5 Cg_endo -63.7 148.41 92.16 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.651 2.234 . . . . 0.0 113.642 173.122 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 5.1 m-85 -135.44 -168.03 2.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.815 165.684 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 52.8 m -58.45 -169.45 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.974 -1.467 . . . . 0.0 110.489 164.184 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.452 ' ND2' ' HB1' ' A' ' 43' ' ' ALA . 0.4 OUTLIER -100.77 -37.67 8.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.23 163.046 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 35.4 m-70 -157.79 172.8 5.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-O 122.195 0.998 . . . . 0.0 109.456 167.154 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.53 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 27.0 Cg_endo -63.59 -11.53 4.19 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.486 -2.297 . . . . 0.0 112.516 -19.081 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 58.6 m -58.27 -40.57 82.22 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.71 -158.615 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -61.12 -30.99 70.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.276 -172.714 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.3 t -108.26 24.16 13.43 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.488 176.468 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.332 -0.165 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.246 -175.28 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.636 0.591 . . . . 0.0 113.636 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.94 168.31 20.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.413 177.941 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 12.6 t -77.53 130.93 72.59 Favored Pre-proline 0 C--O 1.246 0.869 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.554 -163.092 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.522 ' HG3' ' HG3' ' A' ' 21' ' ' LYS . 4.1 Cg_exo -68.91 -14.82 39.47 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 C-N-CA 123.23 2.62 . . . . 0.0 113.397 168.679 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HE2' ' HD2' ' A' ' 49' ' ' PRO . 8.9 tptp -95.68 -72.36 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.235 -169.545 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -91.74 -23.17 19.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.568 -163.098 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 74.12 55.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 -167.621 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.27 176.91 6.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.699 155.915 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.85 151.26 19.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.783 171.997 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 70.5 t -113.25 111.05 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.852 -163.535 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.33 -167.99 1.04 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.405 -173.779 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -62.56 -83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.203 -164.934 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.58 -15.41 59.25 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.609 -163.233 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -95.87 41.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.98 174.348 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.4 140.88 47.69 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.598 170.781 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.521 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.3 m -131.32 134.32 61.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.838 159.285 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -103.01 139.06 39.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.422 -169.039 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.488 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 3.6 t -177.63 122.55 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.193 -165.965 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 44' ' ' GLU . 2.0 mm? 60.23 32.6 20.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.506 -171.218 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.42 61.69 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 164.163 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -145.15 125.52 13.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 164.204 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.94 179.81 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.411 -161.028 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.521 ' HB2' HG21 ' A' ' 16' ' ' VAL . 27.1 m95 -148.34 175.81 10.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 114.205 -1.361 . . . . 0.0 109.724 -176.916 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 46.2 m80 -95.35 150.26 20.46 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.563 172.24 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -50.09 86.12 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.873 -167.594 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -65.51 -36.19 35.28 Favored 'Trans proline' 0 N--CA 1.483 0.89 0 C-N-CA 122.696 2.264 . . . . 0.0 113.526 176.267 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.2 -47.12 87.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.201 -165.174 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.428 ' CD2' ' NE2' ' A' ' 42' ' ' HIS . 5.0 tp -59.96 92.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.402 -159.774 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -132.29 165.11 24.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.252 -171.257 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.9 t -61.4 179.39 0.22 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.307 172.333 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 2.6 tp10 -143.93 22.99 1.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.967 162.605 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.432 ' CG ' ' CE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -128.79 -37.23 1.76 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.719 -171.426 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.4 p -106.97 -48.3 3.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.483 165.938 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.99 58.32 0.88 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -169.648 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.6 141.39 46.61 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.966 -0.617 . . . . 0.0 110.459 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.533 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -74.66 152.67 39.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.405 -170.455 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 22.9 mt -117.87 161.13 20.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.336 -168.529 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.99 -175.01 2.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.367 -167.511 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 p -61.04 -18.68 59.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.383 -167.823 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.69 68.32 0.03 OUTLIER Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 169.548 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.08 10.55 5.93 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 167.356 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 3.8 p80 -93.0 -169.74 2.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.415 176.793 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -131.66 -168.79 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.142 168.286 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HB3' HD22 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -166.67 160.61 15.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.049 168.144 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.463 ' N ' ' HG2' ' A' ' 44' ' ' GLU . 85.5 t60 -132.44 72.06 1.49 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.96 -177.335 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 58.4 87.17 0.08 Allowed 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.918 -179.603 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.81 -21.27 46.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 165.086 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.51 96.38 19.01 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.669 0.747 . . . . 0.0 109.866 -167.991 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.514 ' HD3' ' CH2' ' A' ' 23' ' ' TRP . 16.1 Cg_endo -59.49 142.67 99.29 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 122.256 1.97 . . . . 0.0 113.627 175.752 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 73.6 m-85 -135.72 -177.1 4.52 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.017 176.461 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 65.4 m -58.98 -178.21 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.526 168.344 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.78 -27.95 14.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.018 160.976 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.521 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 51.8 m-70 -169.52 166.53 5.78 Favored Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.497 172.119 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.521 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 Cg_endo -69.16 -6.75 8.6 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.574 -1.844 . . . . 0.0 113.673 -12.071 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HA ' ' HB1' ' A' ' 58' ' ' ALA . 66.4 m -60.52 -49.56 77.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.401 -162.727 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.92 -38.07 84.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.418 -171.455 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -106.07 32.91 4.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.496 170.208 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.515 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.284 169.742 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.479 0.53 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp 63.71 156.68 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.343 170.614 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.4 t -80.46 132.33 59.04 Favored Pre-proline 0 C--O 1.244 0.787 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.408 -162.006 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.0 Cg_exo -69.06 -19.78 38.99 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 123.267 2.644 . . . . 0.0 113.312 167.128 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -70.86 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.353 -166.304 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -91.19 -24.07 20.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 -165.142 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 73.45 58.3 0.1 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.534 -167.48 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.5 -168.88 1.56 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.891 158.904 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.76 152.09 26.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.574 160.219 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.525 HG21 ' NE2' ' A' ' 24' ' ' HIS . 53.7 t -107.59 110.33 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.746 -163.845 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -74.43 178.23 5.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.151 -179.63 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -61.4 -84.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.567 -165.071 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -6.49 35.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.861 -158.802 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 17.71 11.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.287 -176.858 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 154.29 22.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.246 -163.971 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG1' ' HA ' ' A' ' 25' ' ' ARG . 11.4 m -148.31 121.88 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.254 161.025 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.7 m -102.5 135.4 44.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.389 -163.921 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.511 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 17.7 t -177.99 132.55 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.408 -166.625 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 60.1 34.68 21.27 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.65 -177.276 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.47 18.17 50.03 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 167.268 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -150.34 125.08 9.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.053 166.703 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.86 -179.77 0.3 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.448 -162.592 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.4 m95 -145.91 -172.14 3.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.066 -1.425 . . . . 0.0 109.446 179.773 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.525 ' NE2' HG21 ' A' ' 10' ' ' VAL . 47.9 m80 -103.16 148.86 25.24 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.544 169.39 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 30.4 ttt180 -65.56 -50.36 56.96 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.79 -174.225 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.2 Cg_endo -57.31 -22.81 51.27 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 122.531 2.154 . . . . 0.0 113.542 174.152 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -84.16 -57.91 2.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.299 -170.757 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.463 ' HB2' HG23 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -60.79 93.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.456 -166.461 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.5 mtpm? -148.89 150.8 33.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 -174.912 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -66.54 136.08 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.198 161.896 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -115.22 33.41 5.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.044 167.559 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.16 -46.82 3.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.679 167.676 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.3 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.85 179.982 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.52 51.61 3.82 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.456 -1.057 . . . . 0.0 110.456 169.063 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -128.39 128.38 44.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.109 -0.546 . . . . 0.0 110.405 -176.268 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.469 ' HA ' ' CG ' ' A' ' 29' ' ' LYS . 55.8 m -60.98 139.22 58.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.298 168.563 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 13.5 mt -104.8 166.72 10.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.394 -166.359 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.2 -172.01 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.37 -167.935 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -61.02 -18.35 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.368 -168.141 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.61 0.02 OUTLIER Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 169.05 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.37 10.58 9.9 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 165.938 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 7.3 p80 -94.57 -169.91 2.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.422 177.614 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.61 -164.25 1.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.167 168.634 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.536 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -160.18 148.34 16.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.231 174.329 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -128.0 70.32 1.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.884 -166.642 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 58.36 89.64 0.05 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.898 -178.473 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.75 -28.86 12.54 Favored Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 164.847 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -141.98 137.42 15.94 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 121.439 0.637 . . . . 0.0 109.779 -173.553 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.536 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.9 Cg_endo -63.57 150.83 87.53 Favored 'Trans proline' 0 N--CA 1.486 1.05 0 C-N-CA 122.649 2.233 . . . . 0.0 113.505 169.067 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 86.1 m-85 -141.05 -164.9 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.949 162.799 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 13.5 m -57.43 -177.52 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.641 167.602 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -100.38 -26.12 13.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.844 158.351 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 50.6 m-70 -170.82 166.22 4.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 CA-C-N 114.645 -1.162 . . . . 0.0 109.343 172.178 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.503 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 Cg_endo -71.08 -7.84 12.62 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.656 -1.81 . . . . 0.0 113.604 -12.279 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.526 ' HA ' ' HB1' ' A' ' 58' ' ' ALA . 62.8 m -60.06 -32.42 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.534 -160.87 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -77.19 -36.08 55.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.334 -172.538 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 19.6 m -93.55 24.04 4.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.467 169.813 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.526 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.245 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.345 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 N-CA-C 113.513 0.543 . . . . 0.0 113.513 . . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -174.84 143.48 0.74 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.271 -168.541 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.1 t -80.79 131.08 61.5 Favored Pre-proline 0 C--O 1.245 0.85 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.399 -162.361 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 5.3 Cg_exo -68.56 -15.85 41.95 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 123.277 2.651 . . . . 0.0 113.372 168.39 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.37 -71.41 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.384 -167.743 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.6 p -91.53 -23.02 20.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.474 -162.249 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 t0 73.71 57.34 0.1 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.535 -166.444 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 174.68 8.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.971 158.556 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -93.14 150.5 20.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.701 168.205 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG23 ' CD2' ' A' ' 24' ' ' HIS . 55.6 t -111.4 113.63 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.829 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 12' ' ' PHE . 60.7 t80 -66.11 170.06 6.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.421 177.278 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.493 ' N ' ' CD2' ' A' ' 11' ' ' TYR . 38.3 m-85 -61.89 -82.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.515 -169.347 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.74 -10.96 60.37 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.758 -162.598 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -103.8 44.49 1.02 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.06 168.848 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -109.7 151.49 26.84 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.444 171.117 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.5 m -136.66 147.54 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.863 160.165 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 m -116.22 135.31 54.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.443 -166.783 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 t -178.17 123.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -171.156 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.468 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.9 mm? 60.26 32.42 20.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.423 -171.029 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.28 18.72 65.52 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 162.883 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.55 128.26 19.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 166.377 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.77 177.75 2.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.367 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 30.7 m95 -146.49 178.22 8.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.614 -176.253 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CD2' HG23 ' A' ' 10' ' ' VAL . 45.7 m80 -98.79 140.22 33.3 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 114.075 -1.421 . . . . 0.0 110.494 169.035 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.541 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.38 -46.67 94.87 Favored Pre-proline 0 CA--C 1.544 0.73 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.848 -172.103 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.541 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 11.8 Cg_exo -48.78 -37.26 35.27 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.713 2.275 . . . . 0.0 113.486 167.781 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.45 -58.79 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.359 -165.389 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.515 HD12 ' CE1' ' A' ' 42' ' ' HIS . 2.0 tp -60.54 89.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.368 -164.575 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.515 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 mtmt -128.99 177.03 7.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.112 168.482 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.9 t -59.82 166.6 2.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.401 169.057 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -131.33 25.51 4.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.766 162.006 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.467 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tppm? -114.19 -63.59 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.324 169.147 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -92.05 -42.02 10.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.493 -165.333 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.2 62.5 0.81 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 -171.128 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -132.87 144.9 50.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.469 173.972 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.443 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -70.97 143.68 50.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.497 170.053 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.515 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 88.0 mt -109.08 -168.22 1.31 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.437 -169.412 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.8 170.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.249 -167.385 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.01 18.5 11.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.423 -175.716 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.62 50.61 0.06 OUTLIER Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 162.8 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 58.34 54.1 40.41 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 156.515 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.515 ' CE1' HD12 ' A' ' 28' ' ' LEU . 15.7 p80 -60.43 -170.7 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.029 -0.585 . . . . 0.0 110.586 178.25 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' A' ' 56' ' ' TYR . . . -135.63 175.69 9.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.404 -177.672 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -160.49 141.49 11.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.068 166.117 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.495 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 2.8 m80 -88.79 -42.16 12.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.388 -166.695 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.49 47.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.043 -171.31 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 21.59 53.59 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 -177.473 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -141.18 96.04 7.28 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.852 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.469 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 12.2 Cg_endo -62.97 144.49 93.19 Favored 'Trans proline' 0 N--CA 1.485 0.99 0 C-N-CA 122.714 2.276 . . . . 0.0 113.66 -170.217 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.3 m-85 -126.62 -174.12 3.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 169.969 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 64.3 m -59.2 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.123 -1.398 . . . . 0.0 110.511 169.297 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -110.47 -32.68 6.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.74 158.404 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 11.5 m-70 -145.23 175.01 2.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.365 162.647 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.53 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.7 Cg_endo -59.76 -15.66 2.49 Favored 'Cis proline' 0 N--CA 1.5 1.868 0 C-N-CA 120.651 -2.645 . . . . 0.0 112.331 -25.354 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.8 m -59.14 -50.61 73.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.798 -160.278 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.488 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 11.0 t80 -69.14 -41.21 77.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.462 -172.139 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.9 t -68.9 -21.35 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.415 179.785 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.29 -171.684 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -61.01 146.93 45.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.344 -167.402 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 22.9 t -79.93 129.36 70.77 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.383 -163.86 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.3 Cg_endo -67.88 -18.65 46.93 Favored 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 123.25 2.634 . . . . 0.0 113.497 169.088 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -68.61 0.78 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.251 -166.335 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -94.77 -24.42 17.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.479 -163.358 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t70 73.65 65.88 0.09 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.47 -165.767 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -129.04 -168.47 1.93 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.927 159.573 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -107.49 147.08 30.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.207 163.52 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG23 ' CD2' ' A' ' 24' ' ' HIS . 50.3 t -105.59 116.47 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.767 -163.741 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -166.85 0.65 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.289 -178.889 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.91 -83.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.48 -167.67 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.83 -12.47 61.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.726 -159.081 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -94.44 17.13 13.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.199 179.894 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.1 ptt-85 -88.53 149.24 23.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.329 -168.249 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.9 m -148.25 119.54 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.067 161.66 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 42.9 m -93.03 137.16 32.63 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.397 -174.792 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 2.0 t -174.33 129.68 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.276 -168.815 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.473 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 1.8 mm? 59.98 31.85 20.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.571 -171.781 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.6 61.91 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 166.272 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -147.29 122.57 10.26 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 164.553 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -63.25 -179.82 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.381 -162.011 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.515 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.6 m95 -145.78 178.25 8.3 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.742 -178.015 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 48.2 m80 -98.24 146.53 25.54 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.202 -1.363 . . . . 0.0 110.51 171.055 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 tpt180 -62.04 -47.36 90.96 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.719 -171.949 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -62.85 -28.34 75.62 Favored 'Trans proline' 0 N--CA 1.484 0.961 0 C-N-CA 122.491 2.127 . . . . 0.0 113.531 176.915 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.23 -49.43 19.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.136 -165.743 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 37' ' ' LEU . 0.7 OUTLIER -73.03 94.55 1.9 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.341 -160.449 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.34 170.04 15.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.075 163.719 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -60.06 -174.89 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.318 172.144 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -144.65 22.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.65 157.327 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.02 -33.04 1.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.553 -165.106 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.5 p -110.7 -53.01 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.504 163.999 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.24 68.23 0.61 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -169.114 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -144.18 162.69 35.68 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.449 -178.778 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.07 156.49 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.424 169.88 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HB2' HD22 ' A' ' 28' ' ' LEU . 5.8 mt -129.53 173.84 10.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.261 -166.851 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.21 -162.43 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.351 -160.394 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -61.08 -85.44 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.424 -177.863 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.33 48.36 1.03 Allowed Glycine 0 CA--C 1.539 1.543 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 159.498 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.82 -105.85 0.01 OUTLIER Glycine 0 CA--C 1.533 1.162 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 152.443 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.519 ' NE2' HD22 ' A' ' 28' ' ' LEU . 4.3 p80 -58.74 -170.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.862 -0.669 . . . . 0.0 110.806 -163.675 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -125.55 -166.9 1.61 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.96 160.965 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.473 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -135.73 146.44 47.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.071 -176.31 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -147.48 112.1 5.32 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.759 178.589 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.65 43.1 19.42 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.603 167.739 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.92 46.13 18.24 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 165.629 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 pttt 176.26 97.3 0.1 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -178.184 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.8 144.08 96.62 Favored 'Trans proline' 0 N--CA 1.484 0.955 0 C-N-CA 122.936 2.424 . . . . 0.0 113.555 -167.562 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.9 OUTLIER -131.55 171.18 13.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.728 161.973 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 55.8 m -58.62 145.45 39.6 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 113.836 -1.529 . . . . 0.0 110.81 174.646 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.25 -34.92 75.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.383 -1.28 . . . . 0.0 110.369 175.291 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.1 m-70 -163.07 165.22 15.04 Favored Pre-proline 0 CA--C 1.549 0.909 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.529 166.729 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -69.89 -6.08 9.43 Favored 'Cis proline' 0 N--CA 1.483 0.881 0 C-N-CA 122.594 -1.836 . . . . 0.0 113.689 -11.523 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 93.2 m -60.37 -50.37 73.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.577 -161.693 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -62.03 -37.86 86.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.351 -172.307 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.438 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -107.24 29.28 7.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.474 175.751 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.365 171.212 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.484 0.955 0 N-CA-C 113.494 0.536 . . . . 0.0 113.494 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.527 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 15.3 tttt 65.2 153.58 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.47 165.903 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 15.1 t -72.41 128.61 88.47 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.584 -166.663 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 3.7 Cg_exo -69.99 -7.86 22.17 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.363 2.708 . . . . 0.0 113.39 168.946 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -70.86 0.71 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.276 -173.648 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -97.03 -21.73 17.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.656 -161.152 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t0 73.75 62.98 0.09 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.529 -167.897 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -140.06 166.71 23.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.895 158.947 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.527 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -85.23 152.39 23.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.836 179.609 . . . . . . . . 3 3 . 1 . 045 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 98.8 t -124.65 125.36 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.334 -164.013 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 12' ' ' PHE . 9.7 t80 -172.23 136.79 0.85 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -159.64 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 11' ' ' TYR . 2.2 m-85 70.64 178.12 0.26 Allowed 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -162.677 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.27 -0.5 10.11 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.584 -155.443 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.31 -18.92 52.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.41 171.081 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.516 ' HB3' HG11 ' A' ' 10' ' ' VAL . 9.8 ptm180 -87.03 127.64 35.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.307 -168.432 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.3 m -127.85 171.33 16.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.091 166.18 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -127.31 137.62 52.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.452 -167.585 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.472 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 10.1 t -176.05 126.65 0.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.315 -175.746 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 2.0 mm? 60.22 24.59 13.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.473 -171.622 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.37 -24.76 25.89 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 162.908 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.477 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.5 mptp? -113.45 132.17 55.75 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.23 -178.263 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -70.47 179.35 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.32 -163.246 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.63 164.8 34.17 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.732 -176.923 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.517 ' NE2' HG21 ' A' ' 10' ' ' VAL . 35.9 m80 -85.35 137.06 33.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.481 164.412 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 3.9 tpm_? -61.21 -49.45 88.16 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.817 -172.651 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.9 Cg_endo -58.58 -16.7 31.3 Favored 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 122.568 2.179 . . . . 0.0 113.569 174.234 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.88 -49.41 7.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.298 -177.223 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.514 HD23 ' NE2' ' A' ' 42' ' ' HIS . 1.7 tp -62.92 86.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.378 -167.226 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 11.9 mtmt -133.86 163.8 28.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.359 -178.159 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -64.53 157.78 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 168.157 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -126.31 24.91 6.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.997 164.366 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.47 ' HD3' ' HB3' ' A' ' 55' ' ' CYS . 3.6 tttp -109.29 -64.15 1.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.198 163.01 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -92.8 -19.08 22.1 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.517 -165.084 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.91 53.4 3.53 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 167.554 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -143.93 147.52 34.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.058 -0.571 . . . . 0.0 110.433 179.796 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.49 171.64 1.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.508 176.54 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.526 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 5.3 mt -133.14 176.58 8.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.285 -177.498 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.03 -174.68 2.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.376 -165.804 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.11 -15.5 33.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.437 -170.02 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.56 67.16 0.03 OUTLIER Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 167.519 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -122.62 11.77 8.92 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 165.775 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.514 ' NE2' HD23 ' A' ' 28' ' ' LEU . 4.6 p80 -97.2 -169.19 1.82 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.876 -0.662 . . . . 0.0 110.369 174.754 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.98 -165.64 2.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.246 166.32 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 20.3 tt0 -158.32 151.16 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.997 -174.821 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.408 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 8.4 p80 -93.19 16.26 13.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.562 171.216 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 58.7 72.95 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.675 -169.585 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 167.64 -41.98 0.24 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -179.634 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.85 134.3 4.31 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-O 121.494 0.664 . . . . 0.0 109.652 169.65 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.499 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 18.9 Cg_endo -60.62 145.46 98.8 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 C-N-CA 122.42 2.08 . . . . 0.0 113.625 -178.413 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 3.0 m-85 -133.53 -164.81 1.54 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.76 162.268 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 60.1 m -59.09 -171.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.418 167.794 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -99.86 -31.85 11.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.12 163.186 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 49.6 m-70 -168.23 165.3 7.84 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.542 171.652 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.3 Cg_endo -70.44 -5.58 10.01 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.637 -1.818 . . . . 0.0 113.672 -10.789 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 65.0 m -60.07 -39.75 87.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.494 -161.412 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -67.95 -36.75 80.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.426 -170.957 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.9 p -100.25 21.04 13.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.434 174.768 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.459 ' CB ' ' HE2' ' A' ' 32' ' ' LYS . . . . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.425 172.12 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.486 1.061 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 9' ' ' GLU . 16.5 mtpt 61.94 167.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.379 168.837 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.5 t -80.28 127.36 76.61 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.457 -164.224 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -67.07 -13.86 41.34 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 123.228 2.619 . . . . 0.0 113.465 167.447 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.45 -73.11 0.59 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.41 -172.245 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -91.44 -13.42 32.33 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.479 -168.202 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.11 56.96 3.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.655 -167.99 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 2.5 tttt -110.17 -167.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.965 158.925 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.533 ' HA ' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -107.86 149.57 28.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.263 162.863 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.515 HG21 ' NE2' ' A' ' 24' ' ' HIS . 66.1 t -111.13 113.84 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.921 -166.9 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.07 -168.61 1.32 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.365 175.78 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -72.43 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.451 -165.446 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.77 -1.14 8.41 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.036 -0.666 . . . . 0.0 111.62 -161.076 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.4 17.53 23.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.386 178.348 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 151.97 19.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.311 -165.079 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.462 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 18.2 m -147.98 145.37 18.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.916 160.151 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 28.2 m -118.9 134.83 54.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -167.56 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 20.7 t -178.18 131.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.316 -169.87 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 44' ' ' GLU . 2.1 mm? 60.19 20.65 10.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.454 -169.435 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.68 -24.39 28.2 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 165.438 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.39 141.66 45.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.843 -0.678 . . . . 0.0 110.224 -177.593 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.4 177.01 9.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.394 -164.562 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.521 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.6 m95 -146.95 179.67 7.44 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.665 -176.181 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.515 ' NE2' HG21 ' A' ' 10' ' ' VAL . 38.4 m80 -100.07 136.56 39.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.468 165.424 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.525 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.77 -47.09 44.8 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.85 -172.121 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -47.72 -38.71 29.89 Favored 'Trans proline' 0 N--CA 1.485 1.006 0 C-N-CA 122.711 2.274 . . . . 0.0 113.46 166.525 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -68.05 -56.41 8.99 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.255 -178.393 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.51 HD22 ' CD2' ' A' ' 42' ' ' HIS . 5.7 tp -60.46 89.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.37 -163.768 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.0 pttt -132.4 160.01 37.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.36 171.773 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.2 t -60.74 158.69 12.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.276 167.239 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 23.5 pt-20 -134.44 23.55 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.577 159.043 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -36.62 5.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.505 -179.764 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.6 -52.62 2.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.463 164.838 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 114.56 57.86 0.37 Allowed Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 172.027 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -136.82 143.1 42.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.412 168.836 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.498 ' HA ' ' HB3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -61.77 157.59 17.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.475 175.206 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 6.6 mt -116.19 -173.09 2.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.342 -171.013 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.31 -176.72 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.341 -167.363 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.2 p -61.58 -21.39 64.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.387 -168.513 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.04 53.63 0.06 OUTLIER Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.728 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.49 10.58 14.44 Favored Glycine 0 CA--C 1.522 0.475 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 167.099 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 6.7 p80 -86.57 -170.0 2.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.231 -0.485 . . . . 0.0 110.386 174.629 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -154.45 -168.97 3.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.142 166.687 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -170.7 152.88 3.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.947 -168.45 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -130.87 73.52 1.55 Allowed 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.97 179.731 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.48 83.63 0.12 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.916 -176.465 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.36 45.93 66.52 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 167.397 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.34 90.11 0.51 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.538 0.685 . . . . 0.0 109.845 169.838 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.89 145.25 99.32 Favored 'Trans proline' 0 N--CA 1.485 1.023 0 C-N-CA 122.514 2.143 . . . . 0.0 113.691 -178.318 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 54.1 m-85 -144.48 -159.8 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.906 167.888 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 36.4 m -55.39 179.61 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.26 170.886 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.435 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 32.5 t-20 -105.15 -29.42 10.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.605 157.66 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.525 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.38 166.14 16.84 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.276 164.923 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.525 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -69.83 -14.69 12.63 Favored 'Cis proline' 0 N--CA 1.482 0.81 0 C-N-CA 122.41 -1.912 . . . . 0.0 113.654 -13.629 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.7 m -59.85 -49.56 77.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.511 -160.032 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.84 -48.73 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.265 -170.812 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 6.8 m -72.89 -18.74 61.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.383 -174.471 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.264 -170.289 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . 0.537 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 21.7 Cg_exo . . . . . 0 N--CA 1.485 0.982 0 N-CA-C 113.569 0.565 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER 66.12 125.84 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.672 165.605 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.508 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 21.7 t -93.96 120.83 65.36 Favored Pre-proline 0 C--O 1.245 0.829 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.575 -168.44 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.3 Cg_exo -75.97 -5.66 16.58 Favored 'Trans proline' 0 N--CA 1.483 0.856 0 C-N-CA 123.201 2.601 . . . . 0.0 113.818 173.628 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.526 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.94 -78.65 0.38 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.573 -179.719 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -77.04 -23.21 52.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.501 -173.016 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 71.89 47.7 0.31 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.475 -173.762 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.7 -168.91 1.61 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.829 159.277 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -108.67 154.65 21.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.708 160.975 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.52 HG21 ' NE2' ' A' ' 24' ' ' HIS . 54.1 t -114.94 115.36 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.403 -162.894 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -92.17 55.09 2.5 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.852 -156.942 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 67.54 -79.99 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.594 173.668 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.07 0.11 25.91 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.383 -162.48 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -107.0 12.69 28.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.254 175.954 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.05 26.06 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.271 -163.083 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' A' ' 25' ' ' ARG . 15.8 m -148.27 121.89 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.843 158.265 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 90.1 m -97.48 136.72 37.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.414 -161.659 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 23.0 t -178.2 137.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.428 -167.799 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.431 ' CG ' ' HG2' ' A' ' 44' ' ' GLU . 2.7 mm? 60.04 22.11 11.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.625 -171.248 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.05 -23.14 22.31 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 168.797 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -122.31 126.73 48.72 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.739 -0.731 . . . . 0.0 110.021 -176.634 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.537 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -60.43 -175.47 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.365 -160.995 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.526 ' CZ3' ' HB2' ' A' ' 5' ' ' LYS . 72.5 m95 -146.49 -172.79 4.03 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 112.892 -1.958 . . . . 0.0 109.501 179.127 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.52 ' NE2' HG21 ' A' ' 10' ' ' VAL . 47.0 m80 -100.75 153.01 19.81 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.612 165.211 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.454 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -69.22 -63.85 1.89 Allowed Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.788 179.943 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -50.84 -17.56 3.37 Favored 'Trans proline' 0 N--CA 1.485 1.013 0 C-N-CA 122.301 2.001 . . . . 0.0 113.455 177.337 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.472 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -80.99 -52.89 6.94 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.394 178.692 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.508 HD12 ' CE1' ' A' ' 42' ' ' HIS . 2.9 tp -72.98 82.84 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.319 -163.952 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -138.45 172.07 13.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.304 167.931 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -67.97 157.68 34.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.357 174.297 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.36 23.67 5.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.749 161.399 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.95 -41.36 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.471 -171.45 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -110.98 -52.44 2.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.782 173.264 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.05 59.01 0.25 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 173.076 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.0 mtpp -149.07 168.28 23.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.408 -177.568 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.0 m -92.87 168.05 11.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.381 -178.78 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 42' ' ' HIS . 4.1 mt -131.65 131.45 43.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.419 -167.563 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.91 -170.15 3.31 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.232 173.014 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.42 14.74 8.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.026 -163.45 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.31 45.89 95.3 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 -162.734 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -94.13 9.9 72.13 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 -163.385 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.508 ' CE1' HD12 ' A' ' 28' ' ' LEU . 3.5 p80 -106.32 -171.6 1.93 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.142 0.496 . . . . 0.0 110.545 -173.656 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -176.37 159.63 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.134 175.74 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HG2' ' CG ' ' A' ' 19' ' ' LEU . 1.1 pt-20 -109.47 140.7 42.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.961 -165.134 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -94.41 41.22 1.09 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.797 1.284 . . . . 0.0 109.506 161.89 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.5 98.78 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.622 -171.833 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.22 37.22 43.03 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 168.4 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mttt 179.95 96.31 0.19 Allowed Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.238 0.542 . . . . 0.0 109.724 172.892 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -63.52 146.5 92.94 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 C-N-CA 122.754 2.302 . . . . 0.0 113.546 -173.521 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -145.13 -162.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.938 166.411 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.7 m -57.52 179.45 0.06 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.724 167.925 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.54 -27.56 12.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.066 161.426 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 44.8 m-70 -164.83 166.99 10.47 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.464 170.178 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.531 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.5 Cg_endo -68.69 -7.94 8.47 Favored 'Cis proline' 0 N--CA 1.482 0.834 0 C-N-CA 122.513 -1.87 . . . . 0.0 113.702 -12.693 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.1 m -60.48 -52.71 64.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.417 -162.461 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -60.72 -33.37 72.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.394 -168.366 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.515 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.9 OUTLIER -112.08 26.78 10.26 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.322 179.97 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.323 178.783 . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 160.89 30.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.406 -168.57 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.2 t -81.15 130.82 61.29 Favored Pre-proline 0 C--O 1.246 0.872 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.461 -162.689 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -69.08 -18.13 40.33 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 123.379 2.719 . . . . 0.0 113.368 166.908 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 -70.9 0.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.381 -167.301 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.1 p -91.65 -24.17 19.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.432 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 73.03 54.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.505 -167.609 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.432 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 4.2 tptp -112.64 -169.27 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.822 158.409 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -109.52 150.97 27.37 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.526 161.386 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -107.74 114.9 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.63 -165.439 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -101.36 56.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.023 0.915 . . . . 0.0 110.079 -158.906 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.27 -80.59 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.354 170.8 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.02 -6.37 56.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.414 -157.615 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -114.09 41.66 2.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.082 163.502 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -86.45 149.16 25.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.367 177.758 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -147.12 122.4 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.623 158.392 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.6 m -100.02 136.89 39.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.399 -162.252 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.504 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.7 t -177.67 127.18 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.307 -166.361 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.463 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 2.6 mm? 60.12 29.79 19.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.699 -171.758 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.51 17.19 47.17 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 167.57 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.24 119.33 12.75 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 164.903 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -62.03 -178.21 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.396 -159.291 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 51.2 m95 -146.47 -174.41 4.45 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 113.838 -1.528 . . . . 0.0 109.473 179.42 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 10' ' ' VAL . 46.3 m80 -100.57 154.61 18.43 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.59 172.021 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.84 -56.75 29.26 Favored Pre-proline 0 C--O 1.241 0.634 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.851 -173.851 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.8 Cg_exo -64.01 -27.87 66.09 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 122.695 2.263 . . . . 0.0 113.545 -179.178 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -69.95 -53.49 17.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.218 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.514 HD13 ' CE1' ' A' ' 42' ' ' HIS . 2.2 tp -60.04 100.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.434 -159.082 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -132.64 147.28 52.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.217 -170.037 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -59.79 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.337 168.554 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.9 tt0 -146.47 25.41 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.753 157.722 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.11 -38.34 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.522 -169.045 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -104.88 -31.59 9.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.32 165.19 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 56.15 1.9 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 160.439 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.61 175.36 3.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.369 161.416 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.39 179.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.44 -162.095 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.497 HD11 ' CG ' ' A' ' 42' ' ' HIS . 6.8 mt -131.73 -172.18 2.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.3 -173.973 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 92.1 m -123.95 137.82 54.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 -176.025 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 t 59.69 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.558 165.372 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.58 44.1 0.18 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 160.224 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.08 11.08 56.35 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.878 -0.661 . . . . 0.0 111.553 -175.705 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.514 ' CE1' HD13 ' A' ' 28' ' ' LEU . 8.1 p80 -90.56 -169.49 2.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.897 -0.651 . . . . 0.0 110.39 172.041 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -154.27 154.45 33.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.14 166.837 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -100.3 146.92 26.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.155 -178.742 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -87.7 -45.88 9.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.813 166.1 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.82 79.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.009 166.264 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.78 -23.29 33.45 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 175.077 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 97.79 25.38 Favored Pre-proline 0 C--O 1.244 0.776 0 CA-C-N 115.003 -0.599 . . . . 0.0 109.697 -173.976 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -65.77 142.05 68.26 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.629 2.219 . . . . 0.0 113.711 -170.161 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.9 m-85 -135.41 167.29 21.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.399 163.486 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 42.9 m -59.53 153.7 19.04 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 113.725 -1.58 . . . . 0.0 110.448 172.741 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -61.81 -45.91 91.79 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.321 179.001 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.5 m-70 -158.36 163.58 23.96 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.517 169.025 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.53 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -71.49 -3.8 10.76 Favored 'Cis proline' 0 N--CA 1.483 0.891 0 C-N-CA 122.748 -1.772 . . . . 0.0 113.817 -9.168 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 88.3 m -60.06 -59.16 5.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.407 -160.982 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -60.63 -40.74 93.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.454 -169.301 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.518 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 13.3 p -64.81 -21.29 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.422 176.835 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.228 -169.149 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.042 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.534 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -146.72 134.94 21.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.318 -169.399 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.4 t -84.38 114.94 57.96 Favored Pre-proline 0 C--O 1.25 1.123 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.158 -163.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -59.82 -20.54 59.73 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.787 2.325 . . . . 0.0 113.278 170.191 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -73.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.389 -175.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -93.55 -21.46 19.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.558 -165.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 72.61 57.22 0.13 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.47 -171.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.23 -168.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.99 159.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.534 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.46 152.24 22.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.572 162.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.523 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.9 t -112.09 112.35 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.627 -163.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 17.4 t80 -69.05 153.34 43.94 Favored 'General case' 0 N--CA 1.458 -0.038 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.285 176.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.495 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 2.7 m-85 -60.44 -62.05 2.15 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.835 -159.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.41 10.61 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.644 -173.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -102.55 13.95 33.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.449 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.0 154.72 17.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.228 -161.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.25 151.98 14.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.748 156.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.58 136.48 52.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.616 -169.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.9 t -174.83 131.83 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.185 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.488 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 3.1 mm? 60.04 34.52 21.39 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.558 -170.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.08 18.18 57.0 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 169.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -137.75 154.01 49.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 164.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -88.14 176.9 7.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.367 -166.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -148.96 -177.25 5.7 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.251 -1.341 . . . . 0.0 109.074 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.7 m80 -99.54 143.22 30.03 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.475 169.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.71 -45.15 96.94 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.844 -167.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.3 Cg_endo -64.05 -36.46 48.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.589 2.192 . . . . 0.0 113.669 174.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.48 -46.71 84.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.233 -165.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.3 tp -62.77 83.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.367 -166.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -142.21 149.72 40.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.425 -166.336 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -65.5 127.59 32.46 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.472 175.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 1.2 tt0 -95.97 22.53 7.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.255 -1.338 . . . . 0.0 110.177 171.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 -58.98 2.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.318 169.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.2 p -104.81 -19.94 13.75 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.851 -170.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.89 37.19 34.14 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 176.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -96.1 128.12 42.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.496 -0.352 . . . . 0.0 110.335 167.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.2 m -61.14 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.524 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 57.1 mt -98.08 167.22 11.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.378 -164.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.447 ' CG2' ' N ' ' A' ' 39' ' ' SER . 59.4 m -125.28 173.78 8.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.228 -164.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.447 ' N ' ' CG2' ' A' ' 38' ' ' THR . 1.0 OUTLIER -61.13 91.96 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.48 -178.51 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.53 57.1 8.54 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.22 12.78 3.55 Favored Glycine 0 CA--C 1.524 0.597 0 CA-C-N 114.757 -0.721 . . . . 0.0 111.701 166.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 6.9 p80 -110.86 -168.96 1.37 Allowed 'General case' 0 C--O 1.231 0.084 0 CA-C-N 114.762 -0.719 . . . . 0.0 110.594 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.95 158.52 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.69 165.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.488 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -110.09 124.93 52.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.974 -160.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.523 ' HB3' ' HG3' ' A' ' 48' ' ' LYS . 86.3 t60 -99.53 163.07 12.66 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.121 158.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.423 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 16.4 mp0 -60.31 92.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.241 -160.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.89 45.99 15.09 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.586 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -177.97 104.81 0.21 Allowed Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 121.6 0.714 . . . . 0.0 109.956 169.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -61.77 172.57 3.63 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.603 2.202 . . . . 0.0 113.668 167.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 63.5 m-85 -169.11 177.55 4.8 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.01 -171.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 83.9 m -58.21 140.69 52.57 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.136 -1.393 . . . . 0.0 110.066 160.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.73 -38.94 86.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.191 164.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.509 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 12.3 m-70 -153.21 173.45 4.59 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.342 165.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.476 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.8 Cg_endo -62.59 -18.71 4.6 Favored 'Cis proline' 0 N--CA 1.494 1.504 0 C-N-CA 121.248 -2.397 . . . . 0.0 112.537 -23.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.1 m -57.49 -41.69 81.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.146 -154.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -60.93 -48.02 83.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.412 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.509 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 24.8 t -72.03 -18.07 61.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.437 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.67 -47.2 7.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.288 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.418 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 49.9 mmm -93.53 -37.2 12.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.463 -169.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.494 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 74.7 m-85 -119.41 81.34 1.7 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.353 177.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 168.38 143.39 3.8 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -173.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -58.13 145.69 91.31 Favored 'Trans proline' 0 N--CA 1.484 0.965 0 C-N-CA 122.464 2.11 . . . . 0.0 113.573 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -133.9 -175.43 3.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.389 -169.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.63 -129.93 3.91 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -66.81 -77.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.333 -0.434 . . . . 0.0 110.421 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 164.37 44.82 0.02 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -170.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -104.09 32.8 3.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.372 -170.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.52 154.66 38.08 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 178.87 7.64 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -170.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -97.18 -35.22 10.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.268 -169.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -165.51 -49.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.117 -168.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.3 m -100.86 123.74 45.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.385 169.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 -70.05 167.62 17.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.379 -169.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t -164.26 -166.5 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.47 170.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -67.8 84.87 0.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.316 -169.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt . . . . . 0 C--O 1.24 0.596 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.349 -170.062 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo . . . . . 0 N--CA 1.485 1.012 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -151.85 140.82 21.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.386 -167.066 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.51 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.7 t -86.96 116.47 66.17 Favored Pre-proline 0 C--O 1.25 1.108 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.104 -163.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.7 Cg_endo -59.51 -18.08 44.76 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 C-N-CA 122.784 2.322 . . . . 0.0 113.233 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -84.06 -69.44 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.466 -171.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.95 -21.92 18.3 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.638 -168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 t70 72.29 53.33 0.18 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.457 -171.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -111.7 -168.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.981 159.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -105.49 152.33 23.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.724 162.757 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.514 HG23 ' CD2' ' A' ' 24' ' ' HIS . 42.3 t -112.2 111.23 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.633 -163.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -73.65 157.63 36.24 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.287 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.17 -62.32 1.95 Allowed 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -158.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.62 -12.34 61.5 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.723 -173.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.515 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 1.6 mp0 -102.31 44.75 0.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.058 170.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -111.2 150.17 29.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.412 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -140.74 146.34 24.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.528 155.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -115.46 138.35 51.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.748 -166.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -178.19 132.09 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.22 -171.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 44' ' ' GLU . 2.9 mm? 60.05 20.67 9.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.572 -171.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.85 -24.41 21.16 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 170.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.422 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -105.17 154.55 20.05 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 114.87 -0.665 . . . . 0.0 110.137 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.2 176.89 6.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.375 -165.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 24.1 m95 -150.49 -175.14 4.98 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.233 -1.348 . . . . 0.0 108.971 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.4 m80 -100.13 150.27 22.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 113.963 -1.471 . . . . 0.0 110.624 168.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.522 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 22.6 mtp180 -61.32 -56.56 32.76 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.922 -170.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 5.9 Cg_endo -58.77 -36.92 96.33 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.413 2.075 . . . . 0.0 113.567 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.81 -46.36 90.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.285 -164.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 tp -60.02 89.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.236 -160.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -138.4 146.57 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.307 -162.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -66.2 123.64 20.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.446 171.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.467 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -96.72 36.95 1.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.954 168.615 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.84 -44.38 0.88 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.208 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.8 p -116.7 -21.62 8.99 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.006 176.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.94 44.51 11.94 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -105.39 131.06 53.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.422 170.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.2 m -61.0 147.35 43.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.368 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 60.7 mt -110.93 173.99 6.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.331 -168.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.01 -175.61 3.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.381 -167.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.7 t -66.71 -18.94 65.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.376 -167.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.9 62.91 0.08 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 171.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -129.15 12.33 6.08 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.8 p80 -103.87 -168.91 1.56 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.981 -0.609 . . . . 0.0 110.436 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.1 158.61 7.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.966 161.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.525 ' HB2' HD22 ' A' ' 19' ' ' LEU . 4.4 tt0 -115.19 121.31 42.57 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.015 -160.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.451 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -75.0 151.17 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.572 157.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.72 76.37 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.931 -176.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.39 -59.52 0.3 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -163.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HE2' ' HG3' ' A' ' 31' ' ' GLU . 14.0 mtpp -155.32 140.19 12.05 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-O 121.339 0.59 . . . . 0.0 110.052 -160.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.508 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 12.2 Cg_endo -66.04 154.15 75.21 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.958 2.439 . . . . 0.0 113.568 165.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 28.7 m-85 -149.02 -167.24 2.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.84 166.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.6 m -57.7 134.24 56.04 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.287 166.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -68.22 -32.09 72.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.909 159.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 11.9 m-70 -150.96 163.42 23.77 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.338 165.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -68.44 -22.53 8.56 Favored 'Cis proline' 0 N--CA 1.487 1.129 0 C-N-CA 122.427 -1.905 . . . . 0.0 112.798 -18.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 85.6 m -56.99 -43.02 81.32 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.214 -153.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -69.5 -37.8 77.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.471 170.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.528 ' HA ' ' HA2' ' A' ' 61' ' ' GLY . 48.1 t -60.77 -17.61 50.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.48 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -99.79 -38.96 8.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.187 -167.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.517 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 14.0 mmt -96.42 -21.49 17.73 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.431 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.517 ' CE1' ' HB3' ' A' ' 59' ' ' MET . 49.7 m-85 -154.19 30.14 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.372 -167.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.528 ' HA2' ' HA ' ' A' ' 57' ' ' SER . . . -68.36 -52.52 26.2 Favored Glycine 0 CA--C 1.543 1.823 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -174.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 61' ' ' GLY . 2.9 Cg_exo -51.86 106.76 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.519 2.146 . . . . 0.0 113.434 -168.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 64' ' ' GLY . 2.8 tptp -98.8 157.56 16.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.467 169.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.413 ' N ' ' HG3' ' A' ' 63' ' ' LYS . . . 79.21 -135.43 15.41 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 -170.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -165.39 109.69 0.86 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.382 -170.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -127.57 47.12 1.04 Allowed Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 169.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -61.17 -43.26 99.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.387 170.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 176.41 -116.71 0.57 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -169.12 84.89 0.09 OUTLIER Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.34 162.26 17.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.425 . . . . 0.0 110.262 -170.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -106.75 -174.24 2.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.011 169.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 t -106.17 -164.24 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.342 -169.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -104.32 127.66 52.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.397 -168.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.2 t 58.33 91.16 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.234 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -80.64 -172.45 3.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.346 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 76' ' ' LYS . 1.4 mmmm . . . . . 0 C--O 1.241 0.607 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.325 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.466 0.525 . . . . 0.0 113.466 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -122.23 157.61 31.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.469 -175.006 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -84.92 119.92 73.14 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.246 -161.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -61.55 -25.02 78.93 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.778 2.319 . . . . 0.0 113.236 169.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -75.43 -74.36 0.21 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.421 -176.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -91.67 -22.41 20.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.608 -166.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 72.72 51.92 0.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.575 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.52 -169.01 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.841 158.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -105.3 155.0 19.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.449 160.306 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.523 HG23 ' CD2' ' A' ' 24' ' ' HIS . 47.9 t -112.29 112.13 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.666 -165.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.19 164.34 26.18 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.273 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.35 -62.4 1.9 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 -159.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -12.94 61.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.712 -173.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -101.22 44.55 1.01 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.093 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.54 144.57 40.55 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.483 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.12 119.65 5.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.606 154.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 95.9 m -99.97 141.49 32.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.365 -163.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.507 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.5 t -170.13 133.87 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.275 -163.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.509 HD11 ' N ' ' A' ' 19' ' ' LEU . 6.8 mp 59.87 18.34 7.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.471 161.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.66 -24.2 8.1 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 164.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -140.05 158.17 44.48 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.218 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.466 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.6 m-20 -84.31 178.33 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.301 -165.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 48.9 m95 -147.91 -174.69 4.63 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 113.689 -1.596 . . . . 0.0 109.486 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CD2' HG23 ' A' ' 10' ' ' VAL . 44.6 m80 -99.92 157.81 16.26 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.198 -1.364 . . . . 0.0 110.659 170.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 ttp180 -66.83 -60.03 6.93 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.817 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -60.39 -20.43 63.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.394 2.063 . . . . 0.0 113.723 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -78.56 -54.64 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.19 -169.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' A' ' 37' ' ' LEU . 1.3 tp -65.05 84.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.327 -163.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.58 148.62 52.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 -170.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.6 t -64.76 127.79 33.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.392 172.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -95.8 34.22 1.55 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.049 171.454 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -56.2 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.426 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.5 p -104.67 -17.93 14.48 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.085 -174.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.05 39.88 44.42 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 174.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 3.3 tptt -118.79 138.07 52.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.991 -0.605 . . . . 0.0 110.449 177.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -68.39 159.99 30.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.382 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.5 mt -124.91 123.47 39.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.468 -170.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.62 -168.05 2.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.528 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.9 t -76.01 73.06 2.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.395 -168.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.61 55.36 0.95 Allowed Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 167.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.78 12.77 5.61 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 162.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.6 p80 -114.14 -168.6 1.38 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.24 -177.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.96 157.84 16.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.874 160.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.49 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.7 131.19 55.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.035 -161.102 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 86.4 t60 -96.44 163.56 13.0 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.371 160.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.429 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 11.5 tp10 -60.79 92.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.108 -162.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 55.25 7.55 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.614 -170.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 176.28 102.98 0.1 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 121.447 0.642 . . . . 0.0 109.876 165.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 18.0 Cg_endo -65.28 149.82 88.03 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.714 2.276 . . . . 0.0 113.627 169.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 50.6 m-85 -143.44 -178.84 6.07 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.007 169.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.5 m -56.23 138.95 49.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 113.49 -1.686 . . . . 0.0 110.802 165.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.7 -31.72 70.99 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.036 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.44 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 27.3 m-70 -161.37 162.38 21.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 CA-C-N 114.715 -1.129 . . . . 0.0 109.251 165.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -73.36 -13.27 19.53 Favored 'Cis proline' 0 N--CA 1.483 0.856 0 C-N-CA 122.65 -1.812 . . . . 0.0 113.609 -13.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 80.7 m -59.5 -42.01 91.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.72 -156.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -66.44 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.306 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -60.64 -11.64 7.88 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.42 -169.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.86 -58.88 2.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.352 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -43.06 9.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.401 -169.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 10.7 m-85 -113.1 110.23 20.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.354 -179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 170.55 -58.01 0.19 Allowed Glycine 0 CA--C 1.544 1.85 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 172.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -52.95 -82.33 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.997 0 C-N-CA 122.481 2.121 . . . . 0.0 113.603 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.6 -77.35 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.356 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 108.4 0.01 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -61.17 -49.52 76.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.361 -0.419 . . . . 0.0 110.305 -170.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.08 105.02 0.1 OUTLIER Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -170.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.513 ' HB3' ' NH1' ' A' ' 67' ' ' ARG . 4.7 mtm105 -63.02 -30.39 71.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.346 -170.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.11 103.71 0.33 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -170.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 112.67 -149.26 18.43 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.485 -1.046 . . . . 0.0 110.485 170.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.72 103.24 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.252 -169.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -141.63 113.91 8.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.053 168.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.93 -62.7 1.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.382 -169.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 m80 -61.06 169.03 2.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.401 -170.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.5 p -117.54 87.33 2.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.433 170.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 68.2 -79.09 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.364 169.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.502 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.432 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo . . . . . 0 N--CA 1.485 1.025 0 N-CA-C 113.612 0.581 . . . . 0.0 113.612 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -142.28 151.16 41.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.5 172.07 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.9 t -88.01 117.74 68.8 Favored Pre-proline 0 C--O 1.251 1.155 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.253 -162.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -59.72 -22.1 66.09 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.732 2.288 . . . . 0.0 113.171 169.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -74.09 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.441 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.61 -21.26 19.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.61 -164.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.43 58.58 0.13 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.452 -170.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.15 -168.56 1.54 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.01 160.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.8 mt-10 -105.76 152.57 23.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.63 161.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.8 t -112.44 113.09 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.595 -162.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -72.84 156.27 39.06 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.371 177.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -60.35 -62.3 1.97 Allowed 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.839 -159.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -1.4 10.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.736 -173.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -102.57 14.46 31.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.422 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.96 152.86 18.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.306 -161.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.7 m -145.5 153.56 13.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.65 156.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.33 142.69 35.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.767 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.46 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 38.7 t -177.46 133.35 0.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.284 172.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.462 ' HB3' ' NZ ' ' A' ' 21' ' ' LYS . 3.3 mm? 59.96 32.21 21.03 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.537 -172.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.86 18.34 68.43 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 167.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.462 ' NZ ' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -140.4 155.11 46.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 165.339 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.6 176.99 7.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.305 -164.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 29.2 m95 -149.27 -175.49 5.0 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.196 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 43.3 m80 -100.6 140.61 34.62 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.527 169.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.528 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 17.3 tpt85 -62.02 -46.52 91.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 115.206 -0.907 . . . . 0.0 109.871 -173.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.0 Cg_exo -50.01 -39.62 50.17 Favored 'Trans proline' 0 N--CA 1.484 0.967 0 C-N-CA 122.724 2.283 . . . . 0.0 113.418 169.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.81 -47.62 37.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.268 -164.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.47 HD21 HG23 ' A' ' 16' ' ' VAL . 4.1 tp -66.16 77.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.488 -170.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' HE3' ' HB2' ' A' ' 29' ' ' LYS . 15.5 ptmt -138.31 141.42 39.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.393 -171.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.5 t -60.26 122.01 13.43 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 172.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 20.0 mt-10 -96.88 38.59 1.22 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.166 167.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -39.1 0.76 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.382 -177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.8 p -120.6 -27.57 5.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.056 172.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.29 47.15 5.58 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.534 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -104.25 130.58 52.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.416 167.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.463 HG21 ' N ' ' A' ' 37' ' ' LEU . 85.9 m -64.39 146.83 53.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.373 167.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.0 mt -114.89 131.03 56.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.401 -167.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -78.98 -167.86 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.482 168.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -65.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.453 -168.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -127.49 56.9 0.72 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.72 10.3 3.7 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 114.997 -0.602 . . . . 0.0 111.89 166.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.522 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 27.2 p80 -108.75 -170.16 1.62 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 111.026 -175.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.408 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -146.57 -163.21 1.7 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.845 168.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.517 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -171.12 132.83 0.84 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.302 174.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.46 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 64.3 t60 -95.24 159.3 15.08 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 154.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.68 90.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.018 -161.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.87 -44.09 1.21 Allowed Glycine 0 CA--C 1.53 1.004 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.733 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 7.2 mtmm -132.28 108.53 13.63 Favored Pre-proline 0 C--O 1.243 0.74 0 CA-C-O 121.139 0.495 . . . . 0.0 109.81 -159.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 16.1 Cg_endo -67.75 155.87 68.22 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 123.115 2.543 . . . . 0.0 113.648 165.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.3 m-85 -152.62 -162.16 1.44 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.858 169.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.3 m -57.45 139.09 54.16 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.316 162.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.408 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 55.7 t30 -60.61 -34.67 74.56 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.103 164.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.1 m-70 -158.56 173.1 5.31 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.386 164.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.515 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.1 Cg_endo -63.23 -18.95 5.13 Favored 'Cis proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.466 -2.306 . . . . 0.0 112.603 -22.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.4 m -57.33 -40.36 77.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.219 -154.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -60.93 -48.31 82.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.309 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -65.52 -18.31 65.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.644 177.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.504 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . -83.46 -53.69 5.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.126 -165.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.09 -30.75 7.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.394 -171.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.46 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 11.3 m-85 -103.88 -173.8 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.226 166.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 139.2 140.46 3.95 Favored Glycine 0 CA--C 1.544 1.847 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 173.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -58.04 131.17 41.93 Favored 'Trans proline' 0 N--CA 1.486 1.053 0 C-N-CA 122.479 2.119 . . . . 0.0 113.558 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -17.51 53.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.384 -171.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -162.34 -84.24 0.05 OUTLIER Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 169.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.34 -42.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.293 169.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -117.85 -71.86 0.42 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 169.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 67' ' ' ARG . 2.7 ptm85 -178.7 156.0 0.85 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.408 -0.396 . . . . 0.0 110.444 169.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.64 -69.6 1.29 Allowed Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 157.28 -175.07 34.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -170.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.96 -40.78 12.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.429 -0.386 . . . . 0.0 110.267 -169.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 107.18 18.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.966 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.98 98.63 1.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.456 169.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -93.04 -170.96 2.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.291 169.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.2 m -63.71 -34.69 78.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.369 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -170.16 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.389 169.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.365 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.545 0.556 . . . . 0.0 113.545 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HG2' ' N ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -119.39 142.87 47.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.339 -169.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.9 t -78.72 118.68 73.81 Favored Pre-proline 0 C--O 1.252 1.207 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.47 -162.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -61.8 -12.0 23.43 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 123.011 2.474 . . . . 0.0 113.479 170.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.536 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 3.7 ttpp -93.52 -77.08 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.58 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.8 p -88.5 -19.47 26.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.985 -163.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.72 56.16 0.18 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.497 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.05 -172.57 2.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.013 161.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -97.55 152.78 18.67 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.68 166.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG23 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -116.34 111.71 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.549 -163.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.7 158.56 31.99 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.367 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.429 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 1.1 t80 -60.36 -65.86 0.62 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.803 -159.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -12.51 61.62 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.701 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.97 46.72 0.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.95 168.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 12.7 ptt85 -118.56 149.91 40.55 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.77 170.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.432 HG21 ' HB2' ' A' ' 23' ' ' TRP . 19.3 m -138.62 149.25 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.554 157.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -114.06 136.99 52.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.475 -163.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 24.3 t -178.23 135.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.393 -170.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 59.98 17.91 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.717 -176.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.36 -24.89 30.38 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 166.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.98 164.9 13.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.843 -0.679 . . . . 0.0 110.07 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -90.8 177.44 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.283 -165.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.0 m95 -153.03 173.72 15.07 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 113.907 -1.497 . . . . 0.0 108.99 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 44.7 m80 -92.08 142.65 27.28 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.466 174.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.18 -49.87 86.49 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.793 -172.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.6 Cg_endo -58.29 -41.02 70.66 Favored 'Trans proline' 0 N--CA 1.484 0.915 0 C-N-CA 122.551 2.168 . . . . 0.0 113.613 172.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.536 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.5 m -61.1 -48.13 83.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.213 -171.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD13 ' CE1' ' A' ' 42' ' ' HIS . 4.2 tp -67.71 94.3 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.379 -167.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' N ' HD13 ' A' ' 37' ' ' LEU . 6.7 ttmt -153.16 149.46 28.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.471 -171.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -73.24 122.72 22.39 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.372 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -97.78 42.03 1.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.042 167.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 13.3 tptp -132.3 -49.87 0.93 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.328 172.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -109.26 -31.35 7.6 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.763 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.17 49.16 5.39 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -104.04 132.47 50.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.405 -0.397 . . . . 0.0 110.346 161.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 m -60.56 136.97 58.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.345 166.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 39.8 mt -97.89 169.66 9.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.315 -163.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.5 -174.97 2.66 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.355 -161.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -72.83 67.89 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.316 165.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.94 53.62 2.81 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 172.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.39 12.24 8.45 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 160.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.525 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.5 p80 -110.62 -169.61 1.49 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 114.911 -0.644 . . . . 0.0 110.469 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.55 -163.28 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.72 165.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -155.32 139.29 16.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.189 169.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.485 ' CD2' ' HG2' ' A' ' 46' ' ' GLU . 41.2 t60 -124.59 104.32 8.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.058 172.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.485 ' HG2' ' CD2' ' A' ' 45' ' ' HIS . 6.5 mm-40 58.59 43.35 19.23 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.799 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.84 -20.16 50.37 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 168.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.71 99.73 14.36 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.412 0.625 . . . . 0.0 109.867 -167.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.532 ' HD2' ' HD2' ' A' ' 5' ' ' LYS . 9.7 Cg_endo -66.1 153.9 76.25 Favored 'Trans proline' 0 N--CA 1.484 0.948 0 C-N-CA 122.429 2.086 . . . . 0.0 113.602 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 38.3 m-85 -151.46 -165.75 2.33 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.04 167.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.6 m -57.61 132.26 52.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.99 -1.459 . . . . 0.0 110.395 165.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.86 -36.27 78.74 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.917 162.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.498 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 22.5 m-70 -152.8 168.49 11.32 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.134 161.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 20.1 Cg_endo -67.57 -22.79 7.88 Favored 'Cis proline' 0 N--CA 1.489 1.232 0 C-N-CA 122.43 -1.904 . . . . 0.0 112.838 -17.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.4 m -56.96 -41.2 77.9 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.286 -153.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.39 -61.39 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.368 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.498 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -92.38 23.96 3.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.516 -166.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -121.44 -45.76 2.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.354 172.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HA ' ' HE3' ' A' ' 59' ' ' MET . 24.1 mmt -106.2 -31.33 8.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.42 -169.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.44 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -85.2 93.04 8.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.356 -167.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.34 -65.39 0.01 OUTLIER Glycine 0 CA--C 1.543 1.798 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 171.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.487 ' HB3' ' CE1' ' A' ' 73' ' ' HIS . 1.6 Cg_endo -56.77 -154.84 0.01 OUTLIER 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.471 2.114 . . . . 0.0 113.421 168.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -179.15 131.93 0.11 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.387 168.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 132.86 125.68 2.65 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 83.59 1.23 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.391 . . . . 0.0 110.325 169.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -178.86 -104.16 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -170.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -159.65 157.28 29.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.425 -170.303 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 131.52 5.72 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 65.17 100.68 0.01 OUTLIER Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.9 32.99 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.431 -0.385 . . . . 0.0 110.264 -169.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -96.26 166.58 11.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.087 168.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.75 -82.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.373 -169.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.487 ' CE1' ' HB3' ' A' ' 62' ' ' PRO . 1.9 m-70 -99.72 135.66 40.8 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.405 -170.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 17.0 p 60.69 -172.96 0.13 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.825 176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -133.72 -80.48 0.47 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.341 -170.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 tptm . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.343 -170.033 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.487 1.12 0 N-CA-C 113.5 0.539 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -130.72 139.48 50.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.378 172.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 28.7 t -82.92 122.84 78.19 Favored Pre-proline 0 C--O 1.25 1.097 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.178 -162.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -62.63 -30.97 79.54 Favored 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.99 2.46 . . . . 0.0 113.23 169.015 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -71.08 0.23 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.394 -176.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.9 -22.75 16.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.601 -164.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 72.4 68.37 0.13 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.456 -168.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 -168.23 1.91 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.208 162.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.69 151.41 23.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.341 164.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG21 ' NE2' ' A' ' 24' ' ' HIS . 62.9 t -120.41 111.25 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.846 -162.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.0 163.6 25.74 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.431 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.57 -59.44 5.4 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.887 -160.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.641 -176.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.03 37.87 2.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.058 166.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.441 ' HA ' ' CG1' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -118.69 131.84 56.15 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.943 163.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 19.9 m -112.04 167.62 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.508 156.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 m -126.58 138.03 53.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.546 -167.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.451 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 35.6 t -177.42 137.5 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.395 -177.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.475 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 60.01 17.94 7.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.689 -177.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.13 -24.95 29.48 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.569 -1.013 . . . . 0.0 110.569 166.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.0 160.84 19.11 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 114.883 -0.658 . . . . 0.0 110.129 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -88.42 177.03 6.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.271 -165.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.515 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -150.15 163.14 38.98 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.067 -1.424 . . . . 0.0 109.362 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.7 m80 -82.88 138.45 33.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.347 170.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.91 -46.69 96.81 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.779 -169.083 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_exo -54.59 -43.8 55.59 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 122.697 2.265 . . . . 0.0 113.537 169.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.83 -49.81 74.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.306 -169.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.16 88.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.376 -168.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.435 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.3 142.47 27.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.333 -169.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -60.12 122.13 13.65 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.466 171.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 27.1 mt-10 -96.32 38.23 1.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.964 165.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.79 -50.84 1.24 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.046 175.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.9 p -112.08 -20.42 11.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.874 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.8 44.4 20.03 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -100.58 127.18 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.335 169.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 72.0 m -61.44 139.8 58.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.412 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 77.9 mt -104.32 116.55 32.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.292 -169.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -118.57 -171.23 2.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.531 -172.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 t 57.83 -90.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.098 163.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.36 43.15 0.07 OUTLIER Glycine 0 CA--C 1.533 1.18 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 161.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.7 24.24 15.62 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -167.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 7.7 p80 -101.16 -169.41 1.69 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.597 -0.802 . . . . 0.0 110.52 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.38 158.32 7.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.816 162.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp20? -115.05 133.65 55.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.025 -159.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.49 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 69.2 t60 -102.7 162.64 12.76 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 157.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.416 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 3.9 mm-40 -60.67 90.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.169 -161.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.77 -19.08 12.56 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.757 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -141.1 105.37 6.13 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-O 121.254 0.55 . . . . 0.0 109.773 -162.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.537 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.6 Cg_endo -66.43 161.08 42.54 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.872 2.381 . . . . 0.0 113.62 165.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 81.1 m-85 -159.14 -171.18 3.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.0 173.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.5 m -58.08 139.54 54.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 113.666 -1.606 . . . . 0.0 110.321 165.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -60.36 -35.44 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.261 164.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 11.5 m-70 -156.35 171.3 7.54 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.378 167.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -62.65 -18.11 4.64 Favored 'Cis proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.135 -2.444 . . . . 0.0 112.539 -24.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.2 m -57.61 -41.74 81.86 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.129 -154.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -61.06 -60.02 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.294 174.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.448 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -70.97 -11.4 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.433 -168.577 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.59 -53.16 6.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.372 177.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.96 -37.61 9.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.417 -168.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 11.8 m-85 -121.71 78.03 1.41 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.392 -172.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.28 69.08 0.01 OUTLIER Glycine 0 CA--C 1.544 1.862 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -174.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -57.12 -16.69 22.3 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.524 2.15 . . . . 0.0 113.425 168.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -105.59 -174.68 2.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.363 -169.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.66 143.21 14.81 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.471 ' N ' ' CD1' ' A' ' 65' ' ' PHE . 0.3 OUTLIER -113.41 19.45 16.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.997 0.427 . . . . 0.0 110.394 -169.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -85.53 115.46 4.16 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -171.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -131.13 105.02 7.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.281 -0.46 . . . . 0.0 110.296 170.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -147.19 -75.77 0.02 OUTLIER Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 66.5 79.63 0.2 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.49 81.09 1.49 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.515 . . . . 0.0 110.331 -176.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -170.93 46.39 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.012 -168.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.93 -32.18 71.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.389 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.98 -170.16 1.61 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.336 -169.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.0 m 69.75 135.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.498 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -119.55 -171.85 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.291 -169.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.361 170.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.484 0.97 0 N-CA-C 113.571 0.566 . . . . 0.0 113.571 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -123.88 146.98 48.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.466 -169.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.2 t -83.41 117.0 67.36 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.275 -165.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.63 -22.08 73.57 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.786 2.324 . . . . 0.0 113.238 169.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.44 -73.57 0.27 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.451 -175.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -92.11 -22.54 19.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.526 -167.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t0 72.99 60.48 0.1 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.555 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.45 -169.23 1.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.068 159.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.76 153.1 18.49 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.477 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.524 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.7 t -112.71 112.98 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.573 -167.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -69.0 152.69 44.93 Favored 'General case' 0 C--N 1.335 -0.065 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.212 175.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -59.97 4.55 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.712 -158.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.86 -0.29 10.92 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.581 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.42 15.49 28.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.336 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -96.89 153.41 17.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.248 -161.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.501 HG22 HD21 ' A' ' 28' ' ' LEU . 18.0 m -146.2 149.16 16.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.692 157.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.72 136.82 48.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.753 -169.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.448 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.45 138.77 0.23 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.31 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.468 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 59.98 23.95 13.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.663 -176.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.16 -24.78 28.6 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 166.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -115.43 163.5 15.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.793 -0.704 . . . . 0.0 110.247 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.73 176.02 7.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.418 -168.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 32.2 m95 -147.28 -177.54 5.74 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.115 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' NE2' HG21 ' A' ' 10' ' ' VAL . 42.6 m80 -102.42 141.06 35.85 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.521 169.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.54 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 11.5 mtm180 -60.88 -50.84 83.21 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.896 -171.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.54 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 7.0 Cg_exo -50.54 -36.83 50.86 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.386 2.057 . . . . 0.0 113.521 171.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.34 -52.28 23.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.372 -168.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.508 HD13 ' CE1' ' A' ' 42' ' ' HIS . 3.9 tp -64.4 92.23 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.374 -167.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 pttp -150.15 147.97 28.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.455 -170.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -64.65 121.42 14.44 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.29 171.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -95.36 44.91 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.033 163.562 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.479 ' NZ ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -137.18 -45.26 0.56 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.352 175.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.6 p -115.62 -33.53 5.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.924 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.67 50.15 5.11 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.72 129.1 55.92 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.248 158.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.8 m -61.3 136.95 58.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.286 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 14.9 mt -92.09 134.61 34.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.351 -161.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.411 HG21 ' N ' ' A' ' 39' ' ' SER . 80.2 m -97.37 146.36 25.25 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.937 175.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.411 ' N ' HG21 ' A' ' 38' ' ' THR . 28.3 m 61.24 -156.14 0.35 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.952 159.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -89.99 54.92 3.67 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 156.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -105.45 14.08 47.12 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.8 p80 -113.1 -167.39 1.18 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-N 113.927 -1.137 . . . . 0.0 110.469 173.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.89 159.87 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.301 160.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.468 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -126.1 122.65 36.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.069 -165.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -92.65 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.935 161.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.46 42.25 21.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.832 170.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 23.59 61.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -119.54 84.78 30.72 Favored Pre-proline 0 CA--C 1.541 0.621 0 CA-C-O 121.547 0.689 . . . . 0.0 109.825 176.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -63.61 148.74 92.15 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.511 2.141 . . . . 0.0 113.761 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 52.2 m-85 -154.49 -167.37 2.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.971 171.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.1 m -57.12 133.44 55.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 113.496 -1.684 . . . . 0.0 110.499 163.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -25.5 66.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.003 162.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 20.0 m-70 -166.63 162.69 11.41 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.356 169.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -71.28 -13.83 15.24 Favored 'Cis proline' 0 N--CA 1.482 0.831 0 C-N-CA 122.5 -1.875 . . . . 0.0 113.509 -15.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.0 m -59.7 -43.41 94.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.65 -156.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -60.9 -54.43 45.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.494 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -77.72 -16.01 58.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.358 -167.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.77 -46.58 10.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.258 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG3' ' NZ ' ' A' ' 32' ' ' LYS . 3.9 mmm -106.69 -34.94 7.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.39 -169.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.34 101.45 10.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.301 -167.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.94 77.3 0.03 OUTLIER Glycine 0 CA--C 1.543 1.805 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 171.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -55.94 -11.43 5.47 Favored 'Trans proline' 0 N--CA 1.487 1.137 0 C-N-CA 122.454 2.103 . . . . 0.0 113.323 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 64.05 98.65 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.448 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.89 116.19 0.4 Allowed Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -170.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -63.62 -170.12 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.381 -0.409 . . . . 0.0 110.357 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.95 129.49 46.51 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -169.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 170.38 1.61 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.393 -169.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.97 -64.21 0.26 Allowed Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.454 -1.059 . . . . 0.0 110.454 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 60.95 82.91 0.07 OUTLIER Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 170.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -149.16 -162.1 1.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.158 0.504 . . . . 0.0 110.307 -169.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 58.79 -84.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.692 -167.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.7 m 65.8 -74.96 0.05 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.443 -168.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -61.15 130.7 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.443 -170.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.88 88.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.404 170.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 75' ' ' PHE . 1.5 p90 -130.62 117.91 20.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.356 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.241 0.638 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.375 -170.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo . . . . . 0 N--CA 1.486 1.034 0 N-CA-C 113.615 0.583 . . . . 0.0 113.615 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -122.95 160.03 27.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.416 -167.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -85.92 121.11 73.07 Favored Pre-proline 0 C--O 1.251 1.148 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.096 -164.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -61.25 -28.9 85.52 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 C-N-CA 122.724 2.283 . . . . 0.0 113.163 169.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -70.07 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.426 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.45 -22.13 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.619 -166.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 72.59 54.45 0.15 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.475 -171.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -168.71 1.36 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 159.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -106.46 152.88 23.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.583 161.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 41.7 t -112.7 112.32 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.54 -162.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -75.54 159.76 30.91 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.361 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -60.45 -62.42 1.87 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.778 -159.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.58 11.11 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.688 -173.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -101.99 13.75 33.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.505 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -97.04 151.07 20.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.36 -160.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.463 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.37 156.2 15.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.736 156.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.93 137.13 52.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.667 -169.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.441 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 42.4 t -174.14 136.82 0.52 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.271 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 59.99 18.75 7.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.618 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.58 28.37 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.39 155.24 19.31 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 114.89 -0.655 . . . . 0.0 110.184 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.5 177.19 6.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.323 -166.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 26.6 m95 -149.17 -175.74 5.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.153 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 44.0 m80 -98.67 145.55 26.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.463 168.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.74 -44.86 96.46 Favored Pre-proline 0 CA--C 1.545 0.774 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.838 -166.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -64.71 -35.58 45.65 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.532 2.155 . . . . 0.0 113.547 173.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.22 -44.35 84.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.339 -163.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.73 82.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.354 -174.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 10.7 ttmt -148.58 144.88 27.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.14 -0.937 . . . . 0.0 110.331 -162.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -65.02 126.17 27.2 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.536 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -96.88 27.37 4.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.065 166.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.44 -35.78 2.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.279 -175.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -126.09 -25.98 3.47 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.062 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.58 49.47 6.62 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -175.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.03 124.2 45.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.317 164.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.533 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 95.4 m -61.18 135.09 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.164 167.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 93.4 mt -100.58 139.47 36.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.392 -164.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 73.5 m -60.62 154.35 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.184 163.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.6 t -66.29 62.69 0.04 OUTLIER 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.486 160.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 146.95 144.74 4.08 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.371 -162.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.91 13.53 83.55 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 119.853 -1.165 . . . . 0.0 111.483 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -112.22 -170.0 1.58 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 114.667 -0.767 . . . . 0.0 110.813 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.509 ' HB2' ' CD2' ' A' ' 56' ' ' TYR . . . -152.04 -162.77 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.604 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.5 tt0 -170.02 138.1 1.68 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.183 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 9.8 p80 -96.49 173.03 7.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.775 157.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 89.01 0.21 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.083 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.07 -65.95 0.33 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -168.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -152.61 144.78 16.79 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-O 121.521 0.677 . . . . 0.0 109.96 -162.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.4 Cg_endo -72.73 171.26 17.65 Favored 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.834 2.356 . . . . 0.0 113.62 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 29.5 m-85 -155.94 -164.55 1.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.241 165.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.4 m -57.91 135.68 56.93 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.258 162.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -60.85 -34.52 74.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.054 162.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 25.3 m-70 -157.6 164.25 22.11 Favored Pre-proline 0 CA--C 1.552 1.03 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.335 166.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.423 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.47 -15.69 16.93 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.584 -1.84 . . . . 0.0 113.534 -14.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.0 m -59.57 -41.91 91.28 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.826 -156.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.509 ' CD2' ' HB2' ' A' ' 43' ' ' ALA . 9.6 t80 -61.18 -56.94 14.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.452 172.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.7 t -62.99 -20.51 65.35 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.372 -171.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.02 -47.22 5.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.184 -166.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.9 mmm -98.68 -20.03 17.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.382 -163.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 0.6 OUTLIER -61.05 99.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.351 -163.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.51 -137.37 2.69 Favored Glycine 0 CA--C 1.545 1.924 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 167.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -57.97 -59.72 0.5 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 C-N-CA 122.483 2.122 . . . . 0.0 113.378 166.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.83 -49.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.263 167.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.7 -172.27 6.52 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 167.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -141.41 -52.22 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.27 -170.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -104.97 176.07 22.57 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -85.41 144.9 27.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.391 -0.404 . . . . 0.0 110.364 -169.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -119.49 -67.3 0.3 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 170.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 61.79 97.39 0.01 OUTLIER Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 170.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -175.53 143.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.439 -0.381 . . . . 0.0 110.279 169.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 58.4 102.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.67 167.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.2 t -177.02 98.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.398 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.8 p80 58.36 95.98 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.682 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -63.83 -160.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.428 170.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -61.03 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.387 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.456 ' HD2' ' HA ' ' A' ' 76' ' ' LYS . 6.4 tptp . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.401 -170.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.64 0.592 . . . . 0.0 113.64 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 147.36 41.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.405 -170.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.6 t -85.64 118.94 71.57 Favored Pre-proline 0 C--O 1.25 1.13 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.178 -164.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.514 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 3.0 Cg_endo -59.49 -27.51 85.14 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 122.518 2.145 . . . . 0.0 113.131 169.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -72.63 -70.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.448 -174.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -96.78 -21.92 17.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.626 -165.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 72.33 53.18 0.17 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.544 -173.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -112.72 -169.06 1.41 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.944 159.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -101.98 151.01 22.63 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.596 163.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 46.8 t -110.55 110.69 33.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.616 -167.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.43 161.67 29.03 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.385 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -60.15 -62.3 1.97 Allowed 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -158.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.14 60.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.731 -175.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -104.39 49.26 0.82 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.861 167.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 143.13 45.85 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.504 -1.225 . . . . 0.0 110.601 170.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 m -132.5 117.93 33.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.442 152.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.1 m -97.75 142.43 29.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.402 -173.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.1 t -177.72 137.27 0.2 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.089 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.514 HD11 ' N ' ' A' ' 19' ' ' LEU . 4.6 mp 60.27 16.88 6.52 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.431 -1.258 . . . . 0.0 110.603 -172.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.99 -25.63 24.74 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 164.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -117.17 149.67 39.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.807 -0.696 . . . . 0.0 110.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -85.7 177.69 7.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.193 -165.298 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.514 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 31.2 m95 -151.49 -176.59 5.65 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.483 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 10' ' ' VAL . 44.2 m80 -97.71 150.21 21.45 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.59 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.536 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.7 ttt180 -61.3 -48.87 90.14 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.83 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 3.9 Cg_exo -66.85 -26.27 44.75 Favored 'Trans proline' 0 N--CA 1.484 0.931 0 C-N-CA 122.502 2.134 . . . . 0.0 113.569 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.55 -51.97 10.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.228 -164.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.449 HD11 ' CD2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -61.92 91.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.403 -160.844 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.52 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 mtpp -145.76 153.39 40.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.327 -172.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -65.23 122.42 17.07 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.242 163.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -96.0 28.53 3.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.117 169.121 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -50.42 2.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.074 177.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.9 p -112.26 -20.25 11.93 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.916 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.46 40.12 20.01 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 126.36 41.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.435 -0.383 . . . . 0.0 110.326 167.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.4 m -61.08 137.21 58.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.27 168.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.54 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 46.1 mt -99.64 161.24 13.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -164.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.73 -163.53 1.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.229 -166.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.49 20.86 6.78 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.471 -177.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.22 55.34 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.34 12.77 4.34 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 170.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 12.6 p80 -106.73 -168.94 1.48 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.707 -0.747 . . . . 0.0 110.745 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -150.61 -169.97 3.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.991 165.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.21 141.24 48.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.124 170.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.6 t60 -139.92 101.54 4.2 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.846 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 58.62 46.42 14.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.627 -169.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 63.54 19.36 62.4 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.611 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.92 98.5 42.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 121.199 0.523 . . . . 0.0 109.73 169.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.509 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 11.3 Cg_endo -54.94 141.37 78.42 Favored 'Trans proline' 0 N--CA 1.487 1.088 0 C-N-CA 122.055 1.837 . . . . 0.0 113.446 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 97.5 m-85 -150.49 -179.23 7.05 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.106 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.8 m -56.72 131.16 48.34 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.472 165.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.97 -33.64 73.52 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.886 161.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.6 m-70 -155.94 164.83 20.01 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.258 163.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.465 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.8 Cg_endo -73.06 -16.82 17.48 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.696 -1.793 . . . . 0.0 113.616 -13.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.7 m -59.59 -43.92 93.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.778 -156.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -61.11 -55.34 33.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.316 177.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 29.6 t -80.94 -16.79 52.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.469 -165.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.82 -40.52 17.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.309 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.437 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 31.7 mmm -78.23 -48.35 15.96 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.413 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 80.9 m-85 -98.19 87.39 3.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.427 -168.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 177.97 76.78 0.06 OUTLIER Glycine 0 CA--C 1.544 1.859 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -172.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -62.27 -85.57 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.644 2.23 . . . . 0.0 113.504 -169.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.03 120.06 24.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.26 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.78 -173.26 6.0 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.69 -65.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.413 -0.394 . . . . 0.0 110.434 169.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 94.16 -95.48 1.93 Allowed Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 -175.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -87.32 116.35 25.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.381 -170.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 148.97 58.27 0.01 OUTLIER Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -170.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -152.69 -130.82 1.59 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.49 133.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.137 -0.531 . . . . 0.0 110.414 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -133.43 -74.3 0.49 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.026 -169.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.0 p -113.53 -164.93 0.96 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.406 -169.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 71.63 25.91 3.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.345 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.53 69.34 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.414 169.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 66.62 176.38 0.23 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.407 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.62 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.437 169.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 N--CA 1.484 0.931 0 N-CA-C 113.568 0.564 . . . . 0.0 113.568 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.6 OUTLIER -138.17 139.95 39.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.443 170.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.1 t -86.07 115.64 62.68 Favored Pre-proline 0 C--O 1.25 1.114 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.258 -164.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -60.05 -16.79 41.34 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 C-N-CA 122.771 2.314 . . . . 0.0 113.313 170.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -69.21 0.67 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.52 -171.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -94.21 -21.44 19.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.608 -170.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.34 52.1 0.18 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.496 -171.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.06 -168.49 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.856 160.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 4.2 mt-10 -106.51 152.08 24.15 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.606 161.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -111.65 111.85 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.653 -164.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.538 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 6.2 t80 -75.46 157.84 33.47 Favored 'General case' 0 N--CA 1.458 -0.054 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.311 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -59.78 -62.1 2.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 -157.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.55 -11.32 60.86 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.671 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.538 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.2 pt-20 -102.73 42.97 1.1 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.17 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.89 149.87 29.25 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.454 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.468 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.3 m -141.44 148.63 20.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.627 155.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.55 137.61 50.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.657 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.433 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 15.8 t -176.33 128.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.336 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.439 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 2.2 mm? 59.93 35.37 21.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.605 -170.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.82 18.04 52.13 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HG2' ' N ' ' A' ' 22' ' ' ASP . 20.7 ttmt -137.11 153.61 50.48 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 164.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.515 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 m-20 -88.68 177.08 6.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.392 -165.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.4 m95 -151.15 -173.25 4.44 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.954 -177.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.7 m80 -102.94 146.03 28.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 113.894 -1.503 . . . . 0.0 110.54 169.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.517 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.6 OUTLIER -60.91 -50.13 86.23 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.862 -169.204 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 6.5 Cg_exo -62.42 -34.8 75.44 Favored 'Trans proline' 0 N--CA 1.484 0.933 0 C-N-CA 122.549 2.166 . . . . 0.0 113.49 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.77 -52.9 58.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.232 -167.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.42 93.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.253 -164.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.535 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.1 mttp -148.15 139.1 23.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.356 -164.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.2 t -65.66 120.81 13.63 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.354 166.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.507 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 5.7 pt-20 -98.69 39.74 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.755 167.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.477 ' HD2' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -132.18 -39.32 1.06 Allowed 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.288 179.238 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -119.89 -22.2 6.87 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.12 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.99 41.44 12.32 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -95.19 122.55 37.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.49 -0.355 . . . . 0.0 110.372 167.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 90.8 m -61.09 135.62 57.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.317 170.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 87.1 mt -101.7 97.83 8.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.314 -167.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.4 t -60.05 -160.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.352 161.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -68.94 0.2 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.611 170.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.91 -161.99 9.8 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 154.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.53 69.16 0.36 Allowed Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 165.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -90.77 -170.83 2.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.912 -0.644 . . . . 0.0 110.951 169.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -165.28 -168.9 1.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.196 172.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.9 pp20? -152.88 139.7 19.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.057 -169.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -137.25 106.61 6.08 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.856 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.38 33.19 22.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.906 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.46 -27.57 10.48 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 166.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 103.01 20.55 Favored Pre-proline 0 C--O 1.244 0.771 0 CA-C-O 121.328 0.585 . . . . 0.0 109.845 -170.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.519 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.7 Cg_endo -63.75 147.81 92.33 Favored 'Trans proline' 0 N--CA 1.484 0.923 0 C-N-CA 122.485 2.123 . . . . 0.0 113.669 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 4.3 m-85 -139.89 -165.27 1.86 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.78 164.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.9 m -57.56 135.11 56.63 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.099 159.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -62.81 -33.0 74.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.927 161.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.443 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 21.6 m-70 -157.29 162.41 27.5 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.408 169.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -71.54 -14.9 15.59 Favored 'Cis proline' 0 N--CA 1.482 0.826 0 C-N-CA 122.548 -1.855 . . . . 0.0 113.477 -14.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.3 m -59.84 -45.95 90.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.691 -156.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -60.84 -53.61 55.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.454 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.443 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.5 p -66.96 -28.71 68.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.334 -170.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.43 -46.93 15.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.302 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.444 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . 1.6 tpt -86.95 -40.28 14.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.545 -169.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.19 91.91 6.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.381 -169.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.76 87.07 1.98 Allowed Glycine 0 CA--C 1.544 1.855 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -56.55 107.88 0.3 Allowed 'Trans proline' 0 N--CA 1.488 1.173 0 C-N-CA 122.426 2.084 . . . . 0.0 113.293 167.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -70.48 81.42 0.57 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.448 -164.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 61.69 -165.03 19.93 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 169.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -169.55 80.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.491 -0.355 . . . . 0.0 110.123 166.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.31 155.48 39.74 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -166.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.89 -39.3 10.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.333 168.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 148.58 97.0 0.18 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 170.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -138.84 102.32 0.35 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.461 -1.055 . . . . 0.0 110.461 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -173.24 82.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.341 -0.43 . . . . 0.0 110.294 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -157.43 84.15 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.074 -168.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.8 t -88.52 158.04 18.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.353 -169.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -101.69 132.87 47.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.323 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.5 m -126.63 92.93 3.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.412 -170.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -116.07 19.38 15.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.48 169.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? . . . . . 0 C--O 1.24 0.582 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.439 -171.294 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.53 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 2.4 Cg_endo . . . . . 0 N--CA 1.487 1.106 0 N-CA-C 113.457 0.522 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.23 139.0 52.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.471 170.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.4 t -85.77 116.63 66.42 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.144 -165.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -60.33 -23.55 74.86 Favored 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 122.723 2.282 . . . . 0.0 113.283 169.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -70.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.466 -174.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -94.91 -22.08 18.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.658 -167.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.48 57.58 0.14 Allowed 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.521 -171.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -117.19 -168.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.919 160.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -104.42 153.61 20.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.688 162.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.523 HG21 ' NE2' ' A' ' 24' ' ' HIS . 40.8 t -113.04 114.21 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.537 -163.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -71.99 156.38 39.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.396 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -60.51 -62.26 1.99 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.837 -159.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.37 -1.17 9.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.688 -173.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.82 14.81 31.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.432 178.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.31 152.05 19.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.286 -161.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.47 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.73 150.12 16.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.646 155.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 m -113.58 135.14 54.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.803 -168.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.7 t -177.69 139.62 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.422 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 60.09 30.24 19.73 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.629 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.42 18.49 79.38 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 166.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -152.79 164.7 37.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.448 -0.376 . . . . 0.0 110.163 166.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 3.8 m-20 -90.65 176.79 6.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.392 -166.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.9 m95 -147.45 -176.71 5.35 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.166 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' NE2' HG21 ' A' ' 10' ' ' VAL . 44.3 m80 -101.36 142.62 32.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.499 168.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.72 -45.37 96.95 Favored Pre-proline 0 CA--C 1.543 0.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.819 -168.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 6.6 Cg_endo -62.96 -34.03 72.56 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.513 2.142 . . . . 0.0 113.647 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -67.48 -56.02 11.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.279 -166.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.484 HD11 ' CD2' ' A' ' 23' ' ' TRP . 1.1 tp -60.59 89.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.391 -164.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.525 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.54 146.32 29.4 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.418 -174.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.3 t -60.12 124.71 21.09 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.354 170.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -96.34 20.1 10.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.133 169.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -105.32 -60.24 1.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.317 166.366 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.6 p -105.81 -21.54 13.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.825 -168.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.5 39.85 20.72 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.38 121.41 37.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.903 0.382 . . . . 0.0 110.194 166.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.99 132.51 54.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.288 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.525 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 60.7 mt -96.8 123.2 40.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.314 -168.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -60.11 -162.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.544 168.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -95.65 32.49 1.81 Allowed 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.522 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -168.0 143.83 8.45 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -170.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.85 13.84 83.2 Favored Glycine 0 N--CA 1.468 0.787 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.284 163.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -106.1 -168.72 1.47 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.581 -0.81 . . . . 0.0 110.713 169.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.53 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -157.67 -177.4 6.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.244 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -168.8 124.6 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.881 -166.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.463 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 84.2 t60 -155.39 121.46 5.14 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.694 -179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.47 39.51 25.0 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.796 -176.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 -21.39 37.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm -98.18 102.81 15.05 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 121.826 0.822 . . . . 0.0 109.845 -168.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 13.5 Cg_endo -59.34 147.87 89.08 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.022 1.814 . . . . 0.0 113.372 168.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 9.8 m-85 -154.92 -166.75 2.39 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.241 169.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.2 m -57.63 135.37 56.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.372 163.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.53 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 13.3 t-20 -60.62 -30.92 70.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.144 162.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.517 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 30.5 m-70 -162.63 164.9 16.06 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.369 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.404 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -71.68 -14.34 15.9 Favored 'Cis proline' 0 N--CA 1.482 0.82 0 C-N-CA 122.517 -1.868 . . . . 0.0 113.586 -14.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.1 m -59.85 -42.3 93.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -156.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.09 -39.58 90.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.376 176.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.517 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 24.7 p -76.12 -18.09 59.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -99.18 -43.42 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.206 -168.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.458 ' CG ' ' HD3' ' A' ' 32' ' ' LYS . 25.3 mtp -60.76 -45.2 95.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.47 171.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.463 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 1.4 m-85 -68.88 85.81 0.33 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.342 -177.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.412 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . 159.9 58.33 0.01 OUTLIER Glycine 0 CA--C 1.543 1.822 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 -170.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.412 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 8.1 Cg_exo -58.32 -76.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.485 1.028 0 C-N-CA 122.607 2.205 . . . . 0.0 113.498 -170.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? 63.75 85.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.285 -167.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.64 100.09 0.25 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -168.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 61.12 -169.98 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.329 -0.435 . . . . 0.0 110.325 169.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 159.66 -167.76 35.3 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 169.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.417 ' HD2' ' HA ' ' A' ' 67' ' ' ARG . 9.7 mmm-85 -128.95 117.68 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.257 -0.472 . . . . 0.0 110.396 170.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 172.53 -24.88 0.08 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 170.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 144.82 -81.23 0.22 Allowed Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 170.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.37 -175.85 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.324 -0.438 . . . . 0.0 110.336 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 58.97 -85.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.776 -167.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.4 p -171.58 -54.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.433 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 65.14 165.51 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.375 169.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.5 t 60.44 28.61 18.27 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.873 175.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -120.16 149.64 41.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.4 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.549 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.397 170.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -134.67 156.7 48.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.424 170.835 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.8 t -81.39 119.26 75.21 Favored Pre-proline 0 C--O 1.25 1.111 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.346 -161.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.19 -19.03 61.85 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 C-N-CA 122.878 2.385 . . . . 0.0 113.233 167.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.67 -77.26 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.47 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -91.5 -19.56 22.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.903 -164.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.23 55.03 0.17 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.495 -173.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -114.74 -168.64 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.995 160.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 7.7 mt-10 -104.77 153.24 21.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.546 161.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 39.1 t -113.21 113.27 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.492 -163.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.38 157.15 37.48 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.42 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.39 -62.38 1.9 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 -159.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.54 -1.07 9.85 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.553 -173.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -102.81 14.21 32.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.442 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.52 152.52 18.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.266 -161.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.467 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.04 147.67 18.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.578 155.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.51 137.06 52.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.675 -168.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.436 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 10.5 t -178.08 130.01 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.297 -171.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.467 ' HG ' ' NH2' ' A' ' 67' ' ' ARG . 1.9 mm? 60.14 28.51 18.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.538 -171.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.01 18.05 70.38 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -138.68 155.1 48.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 164.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.9 177.03 6.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.375 -165.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 25.3 m95 -150.56 -176.74 5.61 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.102 -177.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 43.2 m80 -100.57 142.38 32.11 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.448 169.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.447 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 5.8 mtm180 -61.08 -46.31 96.24 Favored Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.781 -170.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 7.9 Cg_exo -60.84 -36.1 85.45 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.608 2.205 . . . . 0.0 113.535 174.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.44 -46.89 74.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.343 -168.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.449 HD21 HG22 ' A' ' 16' ' ' VAL . 7.6 tp -62.88 93.07 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.441 -166.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -149.31 142.48 25.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -60.01 124.42 20.15 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.551 174.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.35 23.88 5.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.215 171.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -113.16 -59.52 2.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.378 168.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.4 p -104.0 -16.15 15.4 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.863 -169.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 48.97 58.02 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -171.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -104.57 115.23 29.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.453 -0.373 . . . . 0.0 110.323 167.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.9 m -61.26 134.94 57.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.493 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 75.8 mt -97.46 125.81 42.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.425 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -71.6 -162.45 0.08 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.481 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.21 -15.29 32.78 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.605 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -159.25 -179.62 34.21 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -169.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.82 15.42 81.33 Favored Glycine 0 C--N 1.342 0.872 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.337 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.469 ' HB2' HD11 ' A' ' 37' ' ' LEU . 7.0 p80 -109.71 -168.47 1.33 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 114.521 -0.84 . . . . 0.0 110.579 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.12 -169.11 2.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.332 170.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.441 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -150.77 131.69 14.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.989 -168.388 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.49 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 39.9 t60 -135.62 100.45 4.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.994 176.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 58.6 43.89 18.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.832 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.09 -21.53 44.68 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -97.89 100.94 9.48 Favored Pre-proline 0 C--O 1.242 0.686 0 CA-C-O 121.283 0.563 . . . . 0.0 109.807 -172.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -62.31 164.99 16.03 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.378 2.052 . . . . 0.0 113.737 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 71.9 m-85 -161.99 176.61 10.59 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.073 -171.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.8 m -57.86 128.41 36.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.961 -1.472 . . . . 0.0 110.054 160.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -60.86 -32.93 72.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.912 162.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 -154.26 161.4 29.38 Favored Pre-proline 0 CA--C 1.551 1.018 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.154 163.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -74.39 -18.25 18.21 Favored 'Cis proline' 0 C--N 1.354 0.835 0 C-N-CA 122.718 -1.784 . . . . 0.0 113.61 -12.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -58.92 -45.34 90.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.89 -154.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -61.05 -61.89 2.25 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.0 p -72.68 -11.91 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.444 -173.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.89 -56.49 3.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.068 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.459 ' HG3' ' HE2' ' A' ' 32' ' ' LYS . 3.6 tmm? -84.92 -39.42 18.2 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 113.584 -1.644 . . . . 0.0 109.939 -170.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 56.5 m-85 -87.55 -167.32 1.85 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.781 159.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -108.27 -60.9 0.55 Allowed Glycine 0 CA--C 1.544 1.895 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 -158.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -47.44 -87.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.815 2.343 . . . . 0.0 113.733 -161.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 177.86 176.48 0.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.443 -171.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.28 61.39 1.08 Allowed Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.248 -1.141 . . . . 0.0 110.248 167.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -133.25 -73.76 0.49 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.337 -168.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.56 72.09 1.16 Allowed Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 170.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.467 ' NH2' ' HG ' ' A' ' 19' ' ' LEU . 11.2 mtm180 64.99 -167.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.414 175.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 160.29 -34.64 0.43 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -110.39 -30.65 3.27 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -173.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.48 176.54 8.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.323 -0.438 . . . . 0.0 110.244 -169.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 58.55 76.74 0.33 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.572 168.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.465 ' CB ' ' HE2' ' A' ' 76' ' ' LYS . 12.7 t -138.89 -62.16 0.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.413 -169.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -139.97 -79.07 0.3 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.416 -169.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.476 ' HB ' ' CE2' ' A' ' 75' ' ' PHE . 1.6 p -146.31 -54.16 0.26 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.357 178.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.476 ' CE2' ' HB ' ' A' ' 74' ' ' THR . 10.4 m-85 -141.45 113.25 7.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.324 -169.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.465 ' HE2' ' CB ' ' A' ' 72' ' ' SER . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.544 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.405 170.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.487 1.092 0 N-CA-C 113.542 0.555 . . . . 0.0 113.542 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 6.4 pttp -126.12 156.21 40.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.36 -168.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -85.28 116.97 67.76 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.126 -163.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.511 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_endo -60.16 -21.85 67.74 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.584 2.189 . . . . 0.0 113.108 169.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -72.47 0.38 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.484 -173.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.6 p -91.84 -21.16 20.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.598 -169.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.02 52.29 0.13 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.597 -171.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -108.61 -169.33 1.48 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.884 158.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.525 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -106.76 151.72 24.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.531 160.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.52 HG21 ' NE2' ' A' ' 24' ' ' HIS . 54.7 t -112.68 124.91 69.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.711 -166.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.482 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 13.1 p90 -101.29 160.31 14.52 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.488 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HA ' ' HB3' ' A' ' 15' ' ' ARG . 7.0 p90 -59.61 -40.96 89.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.89 -158.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.06 -0.09 38.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.161 -163.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.482 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 0.7 OUTLIER -113.37 9.74 18.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.686 166.203 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.476 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -80.66 141.15 35.22 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.36 -159.116 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.2 m -146.82 125.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.024 160.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -98.79 142.03 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.434 -168.556 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.512 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.6 138.65 0.22 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.566 -168.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 59.92 32.49 21.21 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.726 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.41 -24.09 21.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 168.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' CE ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.35 -174.01 2.52 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 114.864 -0.668 . . . . 0.0 110.022 177.089 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.533 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.2 m-20 -106.4 177.05 4.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.309 -173.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.512 ' NE1' ' HB3' ' A' ' 18' ' ' SER . 37.4 m95 -149.71 -172.29 4.11 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.267 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.52 ' NE2' HG21 ' A' ' 10' ' ' VAL . 42.5 m80 -101.65 159.44 15.31 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.558 170.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.404 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -74.3 -57.05 2.31 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.717 -175.522 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 4.2 Cg_exo -49.44 -22.47 6.16 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 C-N-CA 122.282 1.988 . . . . 0.0 113.411 172.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -87.0 -58.17 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.267 -167.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.489 HD13 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -62.81 83.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.348 -173.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.5 mtmt -156.67 139.55 15.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.266 -164.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -63.12 123.47 18.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.432 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 8.0 pt-20 -97.93 27.67 4.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.819 164.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.15 -50.76 2.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.351 170.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.99 -21.23 10.16 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.955 -175.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.45 43.02 16.69 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -99.81 122.42 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.343 168.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 40.0 m -60.84 137.19 58.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.32 168.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 93.6 mt -101.15 148.64 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.442 -162.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.444 ' CG2' ' N ' ' A' ' 39' ' ' SER . 97.5 m -102.73 168.81 9.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.369 -171.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.444 ' N ' ' CG2' ' A' ' 38' ' ' THR . 0.1 OUTLIER -62.87 78.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.57 179.517 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.43 58.49 0.96 Allowed Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.33 9.61 1.71 Allowed Glycine 0 C--N 1.334 0.458 0 CA-C-N 114.435 -0.882 . . . . 0.0 111.996 168.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 6.1 p80 -112.12 -171.31 1.82 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.983 0.42 . . . . 0.0 110.555 -170.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.474 ' HB2' ' CD2' ' A' ' 56' ' ' TYR . . . -141.64 -164.72 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.612 166.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.75 146.74 2.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.218 162.912 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.519 ' NE2' ' HB2' ' A' ' 48' ' ' LYS . 34.2 p80 -86.96 -165.76 1.38 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.548 155.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.17 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.285 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.66 39.1 41.61 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 172.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HB2' ' NE2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -158.34 108.39 1.69 Allowed Pre-proline 0 CA--C 1.544 0.738 0 CA-C-O 121.315 0.579 . . . . 0.0 109.804 166.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.502 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 11.8 Cg_endo -71.46 154.14 60.59 Favored 'Trans proline' 0 N--CA 1.483 0.878 0 C-N-CA 122.963 2.442 . . . . 0.0 113.71 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 8.4 m-85 -147.14 -164.73 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.908 164.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.8 m -57.49 138.13 55.47 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.261 161.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -60.66 -30.66 70.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.172 163.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.51 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 27.9 m-70 -164.37 164.84 13.57 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.355 168.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.91 -12.96 14.6 Favored 'Cis proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.447 -1.897 . . . . 0.0 113.556 -15.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 68.9 m -59.72 -42.55 93.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.711 -157.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.474 ' CD2' ' HB2' ' A' ' 43' ' ' ALA . 23.0 t80 -60.87 -45.07 95.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.507 176.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.51 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 25.3 t -76.2 -25.16 54.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.527 -172.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.55 -46.83 13.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.286 -174.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -81.83 -43.76 17.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.338 -169.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.492 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 4.2 m-85 -93.47 96.11 9.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.412 -168.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.88 -165.74 19.76 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -60.96 -76.1 0.02 OUTLIER 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.528 2.152 . . . . 0.0 113.533 -170.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.74 146.66 45.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.473 -166.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.65 80.75 0.06 OUTLIER Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -67.34 -37.07 82.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.365 170.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 134.67 -42.16 1.38 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -169.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.7 113.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.491 171.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.02 133.49 49.18 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -170.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.55 64.66 0.35 Allowed Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 170.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.45 -57.74 1.28 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.313 170.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -125.63 -51.86 1.59 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.2 t 65.99 -78.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.349 170.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -98.8 15.23 26.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.725 -170.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.479 HG21 ' CD1' ' A' ' 75' ' ' PHE . 3.7 t 59.34 -163.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.002 167.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.479 ' CD1' HG21 ' A' ' 74' ' ' THR . 1.6 m-85 66.91 -69.43 0.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.357 -171.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.6 mttp . . . . . 0 C--O 1.241 0.63 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.357 170.04 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.486 1.065 0 N-CA-C 113.453 0.52 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.512 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.97 144.19 33.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.408 169.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.5 t -83.18 117.63 69.19 Favored Pre-proline 0 C--O 1.248 1.025 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.17 -162.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -60.46 -22.14 70.59 Favored 'Trans proline' 0 N--CA 1.489 1.227 0 C-N-CA 122.749 2.299 . . . . 0.0 113.222 169.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -73.25 0.31 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.396 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -94.44 -20.87 19.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.692 -165.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 t0 72.57 57.09 0.14 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.547 -172.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.95 -168.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.02 159.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.6 152.97 21.79 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.573 161.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.523 HG21 ' NE2' ' A' ' 24' ' ' HIS . 39.1 t -112.14 112.05 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.472 -163.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -75.75 159.51 30.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.382 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.34 -62.55 1.78 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.866 -159.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.48 -1.88 12.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.645 -173.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -101.86 14.08 32.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.478 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -98.74 146.31 26.02 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.374 -160.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.416 HG21 ' HB2' ' A' ' 23' ' ' TRP . 12.1 m -141.92 126.74 17.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.248 152.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 82.8 m -95.57 132.38 40.76 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.401 -175.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -162.65 122.58 2.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.224 -159.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.482 HD23 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.05 23.77 12.98 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.67 -176.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.73 17.06 66.63 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.696 -0.961 . . . . 0.0 110.696 164.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -151.21 150.38 30.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 162.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.2 178.29 8.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.252 -160.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.517 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 27.9 m95 -152.2 -177.32 6.11 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.237 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.9 m80 -101.09 143.63 30.98 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.053 -1.431 . . . . 0.0 110.526 170.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.4 ttp180 -61.18 -46.48 95.82 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.78 -173.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -58.88 -27.64 84.97 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.647 2.231 . . . . 0.0 113.585 174.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -81.04 -46.96 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.501 HD23 ' CE1' ' A' ' 42' ' ' HIS . 8.0 tp -60.78 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.442 -173.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -135.9 127.48 28.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.409 -164.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -61.35 125.88 25.37 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.353 167.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.0 tp10 -95.65 30.4 2.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.123 168.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.98 -43.03 1.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.173 -177.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.3 p -120.09 -9.32 9.62 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.815 -1.084 . . . . 0.0 111.212 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.82 37.9 95.36 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -95.0 121.47 36.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.28 172.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.2 m -61.31 135.97 57.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.17 166.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.436 HD11 ' HG ' ' A' ' 28' ' ' LEU . 27.3 mt -102.11 123.45 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.378 -165.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.38 -175.65 5.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.498 169.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.4 p -61.06 -9.85 5.15 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.506 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.51 -170.04 1.5 Allowed Glycine 0 CA--C 1.532 1.094 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.736 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.19 76.52 2.13 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -158.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.501 ' CE1' HD23 ' A' ' 28' ' ' LEU . 20.3 p80 -98.61 -167.02 1.43 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.264 -0.968 . . . . 0.0 110.572 169.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.58 -166.67 1.54 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.799 -169.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.53 154.26 3.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.167 164.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 15.0 p80 -92.21 -167.66 1.81 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.533 156.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.98 91.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.173 -176.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.67 53.87 9.28 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 178.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 6.1 ttmm -179.78 106.96 0.19 Allowed Pre-proline 0 CA--C 1.541 0.613 0 CA-C-O 121.764 0.792 . . . . 0.0 110.021 165.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.534 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 12.8 Cg_endo -71.21 148.82 56.6 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.744 2.296 . . . . 0.0 113.665 173.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.7 m-85 -144.1 -171.91 3.66 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.767 162.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 79.5 m -58.2 137.7 56.83 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.156 165.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -67.88 -34.37 76.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.58 -1.191 . . . . 0.0 109.993 163.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.436 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.8 m-70 -150.36 167.68 12.52 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.406 165.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.29 -20.39 6.64 Favored 'Cis proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.818 -2.159 . . . . 0.0 112.628 -21.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.6 m -57.31 -48.13 79.73 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.235 -153.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.472 ' CD1' ' HB2' ' A' ' 60' ' ' PHE . 55.0 t80 -61.07 -55.46 32.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.409 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.436 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.9 t -60.82 -17.74 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.564 -174.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.35 -53.49 4.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.193 -168.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -95.69 -38.34 10.4 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.332 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.472 ' HB2' ' CD1' ' A' ' 56' ' ' TYR . 31.4 m-85 -91.0 -170.24 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.177 165.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.404 ' N ' ' CD ' ' A' ' 62' ' ' PRO . . . 169.41 -56.04 0.2 Allowed Glycine 0 CA--C 1.542 1.763 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.404 ' CD ' ' N ' ' A' ' 61' ' ' GLY . 7.1 Cg_exo -50.95 112.38 0.76 Allowed 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.429 2.086 . . . . 0.0 113.587 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HB3' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -158.81 122.61 3.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.436 -169.422 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.55 -33.89 87.87 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.469 ' CE2' ' HB3' ' A' ' 63' ' ' LYS . 6.2 m-85 69.81 -80.45 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.331 -0.434 . . . . 0.0 110.386 169.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -114.5 176.48 16.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -169.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.54 83.56 2.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.392 -170.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 155.01 134.04 1.82 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -170.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -160.24 163.71 34.02 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -178.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.32 -162.75 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.226 169.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.42 111.32 21.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.038 168.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.5 p -177.54 165.87 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.308 169.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 t60 71.74 -67.67 0.25 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.375 170.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.9 p -61.01 -86.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.406 -169.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -108.3 122.29 46.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.292 -169.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 170.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.086 0 N-CA-C 113.478 0.53 . . . . 0.0 113.478 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -145.13 136.89 25.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.277 -170.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.522 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 32.0 t -85.11 119.92 72.97 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.043 -162.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.511 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -63.25 -19.6 68.81 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 C-N-CA 122.971 2.447 . . . . 0.0 113.375 171.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.527 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 0.2 OUTLIER -85.05 -64.47 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.473 -171.053 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.5 p -96.48 -23.76 16.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.684 -170.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 72.21 64.55 0.13 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.512 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 0.5 OUTLIER -127.38 -170.81 2.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.105 162.019 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -99.66 150.48 22.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.306 163.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.52 HG23 ' CD2' ' A' ' 24' ' ' HIS . 39.9 t -112.58 113.64 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.505 -163.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -68.43 150.79 47.7 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.461 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.35 -62.82 1.59 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.834 -159.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -1.88 11.55 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.603 -174.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -101.85 13.2 35.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.302 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -96.44 155.8 16.61 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.249 -161.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.49 145.16 21.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.423 155.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -114.69 137.59 51.73 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.652 -168.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.448 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 8.7 t -177.69 128.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.334 -169.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.453 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.9 mm? 60.06 28.63 18.2 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.588 -172.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.38 17.5 72.51 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 167.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mmtt -137.22 153.19 50.45 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 163.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.41 176.77 7.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.399 -167.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.511 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 33.9 m95 -148.38 175.53 11.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 114.231 -1.35 . . . . 0.0 109.411 -177.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 40.5 m80 -96.81 138.97 33.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.392 167.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 8.7 tpp180 -60.94 -47.06 96.63 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.861 -165.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -62.23 -35.24 75.42 Favored 'Trans proline' 0 N--CA 1.484 0.914 0 C-N-CA 122.53 2.153 . . . . 0.0 113.666 174.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.527 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.3 m -61.21 -41.32 96.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.173 -171.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.447 HD12 ' CE1' ' A' ' 42' ' ' HIS . 10.2 tp -67.79 103.35 1.41 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -164.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -146.92 157.08 43.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.31 -178.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.1 t -72.18 127.42 32.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.367 171.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -95.83 35.87 1.35 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 114.078 -1.419 . . . . 0.0 110.168 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.51 ' HB2' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -138.08 -46.47 0.52 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.283 -176.258 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -115.87 -18.78 10.67 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.124 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.29 38.85 28.2 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -108.0 136.9 46.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.007 -0.597 . . . . 0.0 110.565 173.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -61.68 150.3 36.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.325 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.526 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 42.6 mt -113.28 154.9 26.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.398 -167.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -170.57 3.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.396 -175.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 t -61.65 -42.37 98.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.416 -176.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.58 59.5 0.42 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -128.21 13.45 6.31 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 111.63 -0.588 . . . . 0.0 111.63 173.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.517 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 8.6 p80 -114.04 -167.65 1.24 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.031 -0.584 . . . . 0.0 110.481 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -174.11 159.1 3.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.044 165.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.453 ' CG ' ' HG ' ' A' ' 19' ' ' LEU . 1.8 pp20? -110.3 134.96 51.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.074 -163.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 85.4 t60 -128.11 99.09 5.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.229 -1.35 . . . . 0.0 109.878 175.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 58.47 41.58 22.48 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.747 -173.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.18 -22.61 38.81 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 168.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -92.36 102.27 6.26 Favored Pre-proline 0 C--O 1.243 0.742 0 CA-C-O 121.253 0.549 . . . . 0.0 109.812 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -58.61 167.91 4.65 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.482 2.121 . . . . 0.0 113.468 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 32.1 m-85 -164.46 170.17 16.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.892 -167.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -57.3 133.98 55.58 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 113.85 -1.523 . . . . 0.0 110.269 160.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -27.99 68.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.07 164.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.2 m-70 -163.8 163.79 15.55 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.354 165.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.403 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -72.36 -13.53 17.32 Favored 'Cis proline' 0 N--CA 1.482 0.824 0 C-N-CA 122.645 -1.815 . . . . 0.0 113.578 -13.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 76.2 m -59.83 -46.34 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -157.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.13 -47.91 80.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.339 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.494 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.26 -14.14 61.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.298 178.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.98 -57.0 5.52 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.183 176.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 60' ' ' PHE . 16.2 mmt -91.53 -16.19 27.57 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 113.749 -1.568 . . . . 0.0 110.346 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 3.2 m-85 -147.64 -168.61 3.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.845 -165.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.36 145.94 10.47 Favored Glycine 0 CA--C 1.543 1.811 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -176.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -61.97 -158.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.503 2.135 . . . . 0.0 113.617 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.99 147.71 23.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.418 169.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.25 107.81 1.81 Allowed Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.464 -1.055 . . . . 0.0 110.464 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 66.96 -80.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.398 . . . . 0.0 110.374 169.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.53 118.72 11.19 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 -169.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.08 140.29 49.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.421 170.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.59 -102.88 0.67 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 170.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.25 63.98 1.68 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 170.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -168.82 123.91 0.9 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.371 -0.414 . . . . 0.0 110.278 169.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -135.14 -75.98 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.958 -168.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.57 139.93 21.36 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.446 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.76 -50.79 5.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.298 169.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.32 171.01 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.37 -170.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 71.77 -75.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.438 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.345 170.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.424 ' HD3' ' NZ ' ' A' ' 21' ' ' LYS . 10.2 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.54 0.554 . . . . 0.0 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' CD ' ' HG2' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -118.86 159.2 24.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.423 -168.828 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.521 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.8 t -81.94 118.72 73.12 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.391 -162.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -59.24 -19.38 49.78 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.766 2.311 . . . . 0.0 113.252 167.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HE3' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -83.36 -77.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.431 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.24 -18.8 22.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.035 -162.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 t70 71.88 51.92 0.22 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.485 -175.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -168.6 1.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.008 161.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.459 ' HG2' ' CD ' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.71 153.07 21.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.657 162.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 39.7 t -112.39 112.95 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.581 -163.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -70.66 154.98 41.33 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.29 177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -60.68 -62.29 1.97 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.796 -160.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.48 10.82 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.614 -173.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -102.46 14.52 31.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.475 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ptt-85 -96.42 155.13 16.89 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.214 -161.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.8 m -147.31 151.73 13.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.812 157.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.58 137.84 47.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.664 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.447 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.8 t -176.02 137.58 0.32 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.143 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 59.97 18.97 8.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.574 -171.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.45 28.93 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' NZ ' ' HD3' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -107.0 157.64 17.64 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.943 -0.629 . . . . 0.0 110.269 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.26 176.83 7.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.382 -166.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.524 ' HB2' HG21 ' A' ' 16' ' ' VAL . 27.8 m95 -149.54 -176.08 5.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.105 -177.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.521 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 43.0 m80 -100.36 138.61 37.19 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.91 -1.495 . . . . 0.0 110.543 169.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.436 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 1.3 ttp-105 -61.17 -47.6 94.23 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.803 -175.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.2 Cg_exo -52.44 -33.5 57.3 Favored 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 122.584 2.189 . . . . 0.0 113.6 170.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.427 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -77.63 -55.53 5.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.252 -170.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.48 78.26 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.381 -175.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 ptpt -137.31 155.44 49.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.416 170.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -59.51 125.88 25.38 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.651 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -93.53 22.67 5.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.226 170.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.08 -60.11 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.33 166.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.4 p -106.32 -21.22 13.16 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.902 -167.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.84 40.98 20.12 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 124.06 33.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.445 -0.377 . . . . 0.0 110.26 165.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 36.6 m -61.56 135.84 57.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.133 166.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.524 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 95.9 mt -102.97 110.16 21.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.388 -161.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -98.86 -167.06 1.43 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.44 171.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 p 58.79 -162.73 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.564 158.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -122.36 47.74 1.0 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 157.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -103.14 15.31 54.92 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 27.2 p80 -104.6 -170.48 1.77 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.473 0.654 . . . . 0.0 111.055 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -152.48 -166.05 2.37 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.161 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -170.87 164.91 7.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.885 164.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.517 ' NE2' ' HG2' ' A' ' 48' ' ' LYS . 31.8 p80 -111.05 106.14 15.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.715 163.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.15 14.85 2.95 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.006 165.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.448 ' HA2' ' HB2' ' A' ' 4' ' ' PRO . . . 126.99 16.28 2.43 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.517 ' HD3' ' HE3' ' A' ' 5' ' ' LYS . 9.4 tppt? -129.66 86.49 55.38 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -173.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.526 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 13.4 Cg_endo -71.29 155.56 60.33 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.665 2.243 . . . . 0.0 113.721 -168.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.7 m-85 -152.99 -164.12 1.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.813 167.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.1 m -58.18 137.34 57.1 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.103 159.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -61.32 -31.58 71.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.964 162.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.447 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.2 m-70 -161.53 164.56 18.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.34 170.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -70.31 -11.7 13.06 Favored 'Cis proline' 0 N--CA 1.483 0.906 0 C-N-CA 122.465 -1.89 . . . . 0.0 113.365 -15.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.5 m -61.99 -45.38 93.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.685 -157.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -61.03 -47.49 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.425 176.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.05 -15.07 62.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.543 -176.009 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.88 -47.83 8.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.209 -173.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 15.9 mtp -90.2 -40.41 12.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.36 -169.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.45 ' CZ ' ' CB ' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -82.19 95.57 7.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.401 -166.49 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -125.07 67.88 0.52 Allowed Glycine 0 CA--C 1.544 1.906 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 168.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.03 114.01 1.43 Allowed 'Trans proline' 0 N--CA 1.486 1.075 0 C-N-CA 122.579 2.186 . . . . 0.0 113.448 -168.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' N ' ' HD2' ' A' ' 63' ' ' LYS . 0.1 OUTLIER 60.99 86.97 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.387 169.622 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.24 122.13 4.69 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 -169.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -166.4 -79.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.412 . . . . 0.0 110.434 170.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -98.87 -91.1 2.0 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -170.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.7 mtp180 -107.03 -80.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.37 -170.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.66 131.46 6.0 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -170.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -67.68 -172.23 6.09 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 170.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.531 ' HB2' HG23 ' A' ' 74' ' ' THR . . . 61.71 -169.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.39 -0.405 . . . . 0.0 110.279 169.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.43 163.12 17.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.015 -168.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 72.3 m 65.9 -84.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.412 169.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -166.92 108.13 0.65 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.348 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.531 HG23 ' HB2' ' A' ' 70' ' ' ALA . 3.9 t -159.17 -59.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.379 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.9 t80 67.31 -79.59 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.408 170.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.446 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 1.5 tmmt? . . . . . 0 C--O 1.24 0.597 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.34 175.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 113.538 0.553 . . . . 0.0 113.538 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 3.1 pttt -119.76 154.88 33.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.355 -167.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.2 t -78.44 117.64 67.52 Favored Pre-proline 0 C--O 1.248 0.974 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.637 -164.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -62.7 -6.88 9.8 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 123.031 2.487 . . . . 0.0 113.397 168.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.464 ' CE ' ' HD2' ' A' ' 49' ' ' PRO . 10.8 tptp -97.69 -75.87 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.346 -178.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -89.89 -12.35 39.21 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.536 -168.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 p30 59.98 53.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.624 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 -168.55 1.44 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.78 157.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -110.17 155.4 22.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.518 0.675 . . . . 0.0 109.626 159.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 24' ' ' HIS . 26.4 t -112.94 114.08 45.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.476 -157.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.04 156.0 39.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.376 177.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CD1' ' HD3' ' A' ' 15' ' ' ARG . 9.9 t80 -60.57 -59.4 5.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 -158.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.44 -0.77 13.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.571 -171.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -102.96 11.94 36.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.585 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.46 ' HD3' ' CD1' ' A' ' 12' ' ' PHE . 2.2 ptm180 -93.55 151.81 19.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.361 -160.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.535 HG21 ' HB2' ' A' ' 23' ' ' TRP . 15.9 m -145.75 145.58 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.494 155.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.22 135.45 54.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.635 -167.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.8 t -178.49 134.13 0.14 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.182 -168.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.489 HD22 ' HG3' ' A' ' 44' ' ' GLU . 3.2 mm? 59.96 18.62 7.71 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.656 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.23 -24.66 30.39 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 167.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mmpm? -110.1 159.18 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 114.815 -0.693 . . . . 0.0 110.107 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.93 176.5 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.289 -166.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.535 ' HB2' HG21 ' A' ' 16' ' ' VAL . 34.3 m95 -148.29 -179.97 7.33 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.184 -1.371 . . . . 0.0 109.106 -177.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 10' ' ' VAL . 38.5 m80 -99.78 141.42 32.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.542 166.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.536 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.55 -49.44 86.96 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.177 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -59.13 -30.4 93.07 Favored 'Trans proline' 0 N--CA 1.484 0.929 0 C-N-CA 122.456 2.104 . . . . 0.0 113.74 176.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.9 -45.35 67.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.277 -175.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.466 ' CD2' HG23 ' A' ' 16' ' ' VAL . 9.8 tp -64.91 84.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.325 -167.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -136.82 141.0 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.49 -169.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -67.78 124.12 22.44 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.445 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.85 42.72 1.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.237 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.506 ' HE3' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -140.52 -37.46 0.46 Allowed 'General case' 0 C--O 1.231 0.097 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.701 -178.287 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -117.52 -31.06 5.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.041 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.13 51.51 4.41 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -173.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.2 126.93 52.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.901 0.381 . . . . 0.0 110.116 164.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.4 m -61.25 133.57 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.228 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.1 mt -94.08 143.93 25.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.421 -163.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.507 HG21 ' N ' ' A' ' 39' ' ' SER . 95.0 m -62.56 155.84 24.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.832 161.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.507 ' N ' HG21 ' A' ' 38' ' ' THR . 71.1 m -60.55 -21.07 62.14 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.083 178.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -121.76 179.69 16.19 Favored Glycine 0 CA--C 1.527 0.836 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.537 162.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.25 13.93 82.77 Favored Glycine 0 C--N 1.342 0.878 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.174 172.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.7 p80 -110.64 -167.33 1.17 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 113.967 -1.116 . . . . 0.0 110.468 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.51 160.36 7.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.151 159.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.51 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -114.88 122.46 46.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.213 -164.321 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.523 ' HB2' ' HG3' ' A' ' 48' ' ' LYS . 1.7 m80 -75.99 -168.25 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.877 160.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.39 85.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.027 -170.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.29 54.41 37.48 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' HB2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -168.04 105.52 0.56 Allowed Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.706 0.765 . . . . 0.0 109.935 170.35 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.51 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.0 Cg_endo -65.46 146.16 84.49 Favored 'Trans proline' 0 N--CA 1.484 0.92 0 C-N-CA 122.824 2.349 . . . . 0.0 113.624 169.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 22.4 m-85 -143.65 -166.05 2.24 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.843 168.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 94.5 m -57.49 129.71 43.03 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.748 -1.569 . . . . 0.0 110.278 165.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.813 159.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.468 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.34 163.24 25.25 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.268 164.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.468 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -72.99 -19.13 15.7 Favored 'Cis proline' 0 C--N 1.352 0.746 0 C-N-CA 122.708 -1.788 . . . . 0.0 113.712 -11.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.1 m -59.1 -45.63 90.39 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.812 -155.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -61.17 -48.63 80.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.427 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -98.67 23.76 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.738 -172.002 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -113.13 -52.59 2.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.234 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.506 ' HG3' ' HE3' ' A' ' 32' ' ' LYS . 12.0 mmt -83.1 -44.69 14.85 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.827 174.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -98.27 -168.37 1.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.091 161.349 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 130.85 66.01 0.1 OUTLIER Glycine 0 CA--C 1.544 1.846 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 172.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.86 174.2 0.94 Allowed 'Trans proline' 0 N--CA 1.485 1.02 0 C-N-CA 122.593 2.195 . . . . 0.0 113.498 169.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.17 -30.41 6.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.4 168.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.81 118.91 5.84 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 169.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -61.12 133.29 55.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.361 -0.419 . . . . 0.0 110.264 -169.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 63.41 -178.51 6.6 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 -170.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.33 107.76 10.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.374 170.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.97 131.22 3.54 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.38 -1.088 . . . . 0.0 110.38 -170.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -131.33 107.01 0.71 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -170.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -92.69 -71.49 0.65 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.259 169.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 58.53 111.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 168.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.7 t -171.0 34.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.459 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -175.22 108.44 0.1 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.348 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -118.06 -60.75 1.76 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.418 169.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.85 96.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.384 169.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.556 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.356 170.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 113.589 0.573 . . . . 0.0 113.589 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.47 159.21 26.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.545 -166.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.0 t -88.04 118.78 70.03 Favored Pre-proline 0 C--O 1.25 1.131 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.221 -162.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -58.81 -23.76 68.53 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.788 2.325 . . . . 0.0 113.14 169.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.79 -73.99 0.28 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.421 -176.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -94.42 -22.05 18.54 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.632 -164.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 71.93 61.6 0.14 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.556 -169.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.71 -167.76 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.058 162.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -103.36 147.66 26.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.299 163.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 49.1 t -109.46 111.97 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.68 -166.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.01 160.77 30.12 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.392 177.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.57 -63.02 1.44 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.75 -160.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.26 -11.0 60.59 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.71 -174.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.22 40.58 1.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.284 172.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.2 149.72 28.97 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.47 -176.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG22 HD21 ' A' ' 28' ' ' LEU . 18.3 m -143.47 145.71 22.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.475 155.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -113.81 139.5 49.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.546 -166.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.5 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 36.8 t -178.1 131.66 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.314 -171.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.496 ' HG ' ' HG3' ' A' ' 44' ' ' GLU . 3.1 mm? 59.99 18.82 7.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.551 -171.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.77 -24.47 26.04 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -105.33 157.72 17.13 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.808 -0.696 . . . . 0.0 110.026 179.262 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.16 177.47 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.299 -163.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.521 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 29.5 m95 -151.87 -175.13 5.1 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.067 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.2 m80 -101.16 144.83 29.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.474 169.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 34.6 tpt85 -61.62 -48.84 89.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.714 -170.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.4 Cg_endo -59.98 -31.71 93.96 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.597 2.198 . . . . 0.0 113.634 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -71.61 -44.99 63.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.278 -167.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.488 HD21 HG22 ' A' ' 16' ' ' VAL . 6.9 tp -66.48 77.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.441 -167.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -133.73 146.76 51.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.283 -173.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.9 t -60.19 128.81 38.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.403 169.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.511 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.2 mm-40 -99.85 26.13 6.61 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.129 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.539 ' HE2' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -114.82 -60.33 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.351 164.305 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.6 p -99.99 -20.41 16.1 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.766 -170.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.79 42.91 24.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 41.4 mmtt -119.04 130.01 55.41 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.988 -0.606 . . . . 0.0 110.373 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 m -61.43 149.85 37.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.449 -173.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 64.9 mt -110.63 125.59 53.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.378 -166.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -83.54 -166.84 1.49 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.705 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t -95.31 35.59 1.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 -165.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.49 58.44 0.01 OUTLIER Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 160.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -139.24 11.21 3.29 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 114.672 -0.764 . . . . 0.0 111.838 163.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 26.9 p80 -113.46 -169.54 1.52 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.201 -0.5 . . . . 0.0 110.982 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.75 -166.86 2.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.816 -1.083 . . . . 0.0 110.05 168.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -139.38 134.83 33.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.168 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 86.4 t60 -114.46 162.52 16.57 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 161.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 50.5 mm-40 -60.06 90.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.332 -160.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.47 25.71 6.85 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 174.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 176.45 140.43 0.22 Allowed Pre-proline 0 C--O 1.242 0.705 0 CA-C-O 121.264 0.554 . . . . 0.0 109.778 161.497 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 13.6 Cg_endo -66.96 161.0 44.43 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 123.038 2.492 . . . . 0.0 113.609 164.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.0 m-85 -150.4 -173.88 4.59 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.881 168.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.8 m -58.12 132.52 53.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 113.789 -1.55 . . . . 0.0 110.159 161.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -61.12 -33.2 73.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.882 164.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.46 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 31.7 m-70 -158.35 162.89 25.97 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.318 163.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.42 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.28 -18.18 16.81 Favored 'Cis proline' 0 C--N 1.353 0.81 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.646 -11.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 82.7 m -59.24 -43.14 92.41 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.907 -154.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.98 -61.31 2.67 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.376 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.46 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.19 -35.67 81.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.456 -174.001 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.16 -47.95 12.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.185 -167.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.539 ' HG2' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -94.36 -37.7 11.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.518 -162.256 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 0.2 OUTLIER -61.05 90.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.333 -164.323 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 175.19 166.72 33.36 Favored Glycine 0 CA--C 1.546 1.98 0 N-CA-C 109.494 -1.443 . . . . 0.0 109.494 -168.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -68.34 56.87 0.9 Allowed 'Trans proline' 0 N--CA 1.485 0.98 0 C-N-CA 122.732 2.288 . . . . 0.0 113.777 -166.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 1.5 tptt 60.28 27.32 16.84 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.619 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.61 92.98 0.07 OUTLIER Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -170.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 10.8 t80 175.59 -78.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.243 -0.479 . . . . 0.0 110.299 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.03 174.89 2.0 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 166.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -64.82 110.26 2.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.369 -0.416 . . . . 0.0 110.386 168.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -13.28 34.22 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.46 -131.49 10.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -178.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.27 106.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.31 169.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -77.52 -56.44 4.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.998 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p 61.43 -164.11 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.402 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.13 149.16 52.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.293 169.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 49.1 p -60.86 177.09 0.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.516 -169.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -72.95 -174.32 1.46 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.351 -169.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.428 ' CE ' ' HA ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.647 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.372 170.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo . . . . . 0 N--CA 1.483 0.904 0 N-CA-C 113.595 0.575 . . . . 0.0 113.595 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.08 147.85 51.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.477 171.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.509 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -85.13 121.25 74.04 Favored Pre-proline 0 C--O 1.25 1.126 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.044 -166.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.22 -33.27 90.56 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 122.888 2.392 . . . . 0.0 113.097 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -63.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.42 -168.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -97.78 -24.17 15.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.749 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 72.6 57.33 0.13 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.519 -171.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.32 -168.75 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.972 160.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -104.35 153.69 20.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.637 161.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.523 HG23 ' CD2' ' A' ' 24' ' ' HIS . 39.4 t -112.94 112.03 38.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.546 -163.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.487 ' CZ ' ' CE1' ' A' ' 12' ' ' PHE . 14.2 t80 -73.14 155.17 39.93 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.181 177.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.2 -59.44 5.41 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -158.827 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 -0.43 12.94 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.506 -172.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -105.81 17.81 23.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.353 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -96.3 152.09 18.91 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.249 -163.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.92 145.35 21.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.59 156.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -115.38 137.11 52.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.517 -165.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 t -178.46 128.04 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.247 -170.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 59.84 36.02 21.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.627 -171.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.12 17.9 53.39 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 168.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.69 156.49 47.36 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 164.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.18 176.69 6.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.319 -165.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.6 m95 -149.63 -176.84 5.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.12 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.6 m80 -99.93 146.5 26.6 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 113.954 -1.475 . . . . 0.0 110.585 168.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -61.02 -48.35 92.73 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.774 -168.234 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.3 Cg_endo -63.63 -35.31 59.4 Favored 'Trans proline' 0 N--CA 1.483 0.868 0 C-N-CA 122.555 2.17 . . . . 0.0 113.638 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.95 -50.73 65.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.209 -164.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.473 ' HA ' ' HG2' ' A' ' 49' ' ' PRO . 2.3 tp -60.31 89.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.353 -163.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.475 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 57.3 mttt -148.69 149.81 32.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.393 -165.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.9 t -69.04 126.43 29.77 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.451 175.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.9 33.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.066 169.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -130.25 -49.53 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.198 179.104 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.471 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 29.3 p -113.5 -18.49 11.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.214 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.97 39.7 53.65 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -99.29 131.42 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.302 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 28.3 m -60.87 139.57 57.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.465 171.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 51.7 mt -103.07 121.75 43.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.359 -169.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -83.25 -169.08 2.36 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.48 -173.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.1 p -74.47 77.39 1.93 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.376 -167.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.42 56.1 1.72 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 168.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.75 11.87 4.25 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 166.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.536 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.2 p80 -107.36 -170.32 1.68 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.106 -0.547 . . . . 0.0 110.451 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.87 158.7 10.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.833 163.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -112.77 128.33 56.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.211 -160.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.479 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.44 151.97 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.419 157.015 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -62.67 75.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.003 -172.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.462 ' HA3' ' NZ ' ' A' ' 48' ' ' LYS . . . 162.45 -53.52 0.31 Allowed Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.715 -167.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -155.16 140.48 12.37 Favored Pre-proline 0 C--O 1.242 0.68 0 CA-C-O 121.39 0.614 . . . . 0.0 110.048 -163.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.473 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.9 Cg_endo -68.46 149.35 74.64 Favored 'Trans proline' 0 N--CA 1.486 1.032 0 C-N-CA 123.08 2.52 . . . . 0.0 113.708 166.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 8.4 m-85 -138.8 -173.65 3.62 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.79 167.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 86.0 m -57.52 134.59 56.24 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 113.458 -1.701 . . . . 0.0 110.348 164.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.88 -37.15 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.021 162.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.6 m-70 -152.68 169.82 9.04 Favored Pre-proline 0 CA--C 1.546 0.81 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 163.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 22.2 Cg_endo -66.12 -21.47 7.17 Favored 'Cis proline' 0 N--CA 1.491 1.347 0 C-N-CA 122.113 -2.036 . . . . 0.0 112.655 -19.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 73.4 m -57.11 -42.92 81.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.251 -153.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -61.03 -56.32 22.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.458 175.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.516 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -96.98 24.28 6.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.507 -166.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -122.11 -48.59 2.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.256 174.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.2 mmt -101.23 -18.36 16.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.506 -176.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -134.21 14.74 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.366 -165.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.24 160.58 42.4 Favored Glycine 0 CA--C 1.544 1.876 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -171.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -56.12 -18.92 24.95 Favored 'Trans proline' 0 N--CA 1.485 0.971 0 C-N-CA 122.702 2.268 . . . . 0.0 113.559 170.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt 58.84 -169.76 0.13 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.443 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.03 131.51 13.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 -169.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 67.8 162.68 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.349 168.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 172.89 57.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 170.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.8 158.3 30.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.395 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -166.89 -130.69 1.18 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -144.92 -86.05 0.07 OUTLIER Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -170.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -175.43 149.59 1.03 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.411 -0.395 . . . . 0.0 110.324 -169.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.46 139.29 58.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.959 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.99 124.62 21.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.37 -169.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -119.34 -66.6 1.05 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 93.1 m -94.71 139.7 30.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.395 170.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -95.03 145.09 25.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.284 -170.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.0 mmmm . . . . . 0 C--O 1.239 0.536 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.407 -170.063 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.59 158.77 29.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.355 -167.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.3 t -80.59 119.36 76.04 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.349 -161.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -61.1 -18.83 60.42 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.877 2.385 . . . . 0.0 113.198 167.852 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.502 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.9 OUTLIER -83.02 -77.65 0.24 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.424 -179.428 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -90.96 -20.12 22.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.918 -164.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.22 52.54 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.463 -173.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.81 -168.13 1.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.979 159.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 149.59 27.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.355 167.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 ' NE2' ' A' ' 24' ' ' HIS . 41.5 t -111.31 113.53 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.467 -161.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.7 158.75 29.53 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.457 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.11 -62.71 1.67 Allowed 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 -158.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.21 -13.29 61.87 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.813 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -102.78 52.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.783 167.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -115.81 148.63 39.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.527 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.522 HG23 ' HB2' ' A' ' 23' ' ' TRP . 10.2 m -137.35 141.25 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.478 151.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.8 m -105.34 131.03 53.29 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.523 -176.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.406 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.0 OUTLIER -168.71 122.72 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.197 -164.167 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 44' ' ' GLU . 2.5 mm? 60.17 32.97 21.08 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.77 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.93 18.5 78.71 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 163.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.426 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -154.72 160.05 41.1 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 164.372 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.75 176.89 7.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.285 -165.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.522 ' HB2' HG23 ' A' ' 16' ' ' VAL . 23.6 m95 -152.91 -176.45 5.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.03 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.52 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 39.2 m80 -101.76 142.26 33.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.476 168.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -61.16 -50.59 83.47 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.732 -169.469 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 7.3 Cg_exo -57.38 -34.93 98.75 Favored 'Trans proline' 0 N--CA 1.483 0.9 0 C-N-CA 122.618 2.212 . . . . 0.0 113.545 174.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.502 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.8 m -65.74 -46.47 78.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.352 -169.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.516 HD21 HG22 ' A' ' 16' ' ' VAL . 11.3 tp -60.84 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.332 -165.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -139.73 146.63 39.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.327 -164.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.0 t -70.66 119.77 15.3 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 167.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -97.71 29.03 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.988 165.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tptp -110.48 -52.35 2.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.116 170.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.8 -24.36 10.91 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.752 -177.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.72 44.62 7.17 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 2.4 mmtm -111.15 119.82 40.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.306 -0.447 . . . . 0.0 110.401 168.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.5 m -61.08 161.72 8.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.319 168.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 42' ' ' HIS . 5.0 mt -131.78 147.32 52.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.351 -165.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -83.47 -166.2 1.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.586 174.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.0 t -95.76 32.11 1.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.346 -169.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 167.22 57.36 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 164.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.25 12.0 2.29 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 114.763 -0.718 . . . . 0.0 111.825 170.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.526 ' HB2' HD12 ' A' ' 37' ' ' LEU . 2.3 p80 -112.75 -174.62 2.49 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.47 -175.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -152.62 -177.27 6.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 164.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.537 ' HB2' HD22 ' A' ' 19' ' ' LEU . 1.9 mp0 -140.72 114.77 9.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.059 -164.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CD2' ' CE2' ' A' ' 60' ' ' PHE . 1.3 m80 -74.0 -167.84 0.54 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.821 157.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.39 86.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.199 -173.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.25 47.34 91.58 Favored Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.734 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.9 103.26 1.93 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 121.851 0.834 . . . . 0.0 109.848 -175.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.512 ' HB3' HD13 ' A' ' 28' ' ' LEU . 12.3 Cg_endo -66.87 145.2 73.76 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 122.594 2.196 . . . . 0.0 113.79 177.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -143.63 -168.32 2.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.848 171.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 69.2 m -57.51 134.56 56.2 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.197 161.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -61.28 -33.48 73.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.89 160.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.515 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 23.6 m-70 -157.13 163.81 23.78 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.193 164.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.2 -17.42 17.31 Favored 'Cis proline' 0 C--N 1.354 0.828 0 C-N-CA 122.627 -1.822 . . . . 0.0 113.558 -14.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.3 m -59.5 -38.06 79.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.723 -155.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.489 ' CE2' ' CD2' ' A' ' 60' ' ' PHE . 42.0 t80 -62.35 -54.8 35.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.385 168.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.515 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.0 t -61.83 -12.69 18.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.464 -173.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.09 -40.67 12.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.287 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -38.92 20.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.407 -179.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CE2' ' CD2' ' A' ' 45' ' ' HIS . 37.3 m-85 -98.94 92.31 5.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.435 -168.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 120.19 69.74 0.3 Allowed Glycine 0 CA--C 1.542 1.728 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 169.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -57.7 -23.13 56.22 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.502 2.135 . . . . 0.0 113.552 170.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -73.52 0.39 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.46 172.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 61.09 31.22 75.91 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 170.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -109.88 171.58 7.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.042 -0.579 . . . . 0.0 110.309 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.64 90.82 2.12 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 -170.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.438 ' NH1' ' HB2' ' A' ' 71' ' ' GLU . 10.0 tpt180 64.87 142.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.438 -170.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.02 90.22 1.85 Allowed Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -170.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.15 44.11 0.22 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 177.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.26 99.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.351 -0.425 . . . . 0.0 110.274 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.438 ' HB2' ' NH1' ' A' ' 67' ' ' ARG . 2.6 tt0 -94.23 117.92 30.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.04 169.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.3 p -64.4 -164.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.406 169.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.7 m170 68.67 25.79 6.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.295 -170.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.526 HG21 ' HG2' ' A' ' 76' ' ' LYS . 5.5 t -105.57 160.62 15.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.389 169.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -95.9 26.15 4.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.26 -169.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.526 ' HG2' HG21 ' A' ' 74' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.24 0.595 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.349 170.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.099 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -131.11 156.41 45.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.432 170.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.1 t -83.09 118.93 73.18 Favored Pre-proline 0 C--O 1.25 1.086 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.435 -162.78 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.6 Cg_endo -60.15 -19.62 57.66 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.754 2.303 . . . . 0.0 113.373 167.806 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.08 -77.29 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.466 179.519 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.58 -19.74 21.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.725 -163.256 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 16.2 t70 71.78 64.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.455 -170.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -126.08 -168.01 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.167 162.722 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -103.93 148.83 25.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.289 163.759 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.52 HG21 ' NE2' ' A' ' 24' ' ' HIS . 56.1 t -115.92 110.95 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.723 -164.036 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.496 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 27.0 t80 -72.74 154.95 40.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.374 -179.314 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.496 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 15.9 m-85 -60.28 -61.38 2.64 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.945 -158.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.78 -1.18 13.1 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.613 -173.015 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -102.4 12.17 36.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.547 178.046 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -97.11 158.19 15.56 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.178 -160.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.445 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 17.7 m -146.53 145.94 19.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.471 156.386 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -114.39 137.42 51.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.904 -1.043 . . . . 0.0 110.669 -166.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.0 t -178.35 127.48 0.12 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.235 -171.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.461 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 2.6 mm? 59.94 34.87 21.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.557 -170.172 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.75 18.0 51.51 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.541 -1.023 . . . . 0.0 110.541 169.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.44 153.15 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 164.674 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.68 177.17 6.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.289 -165.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 26.1 m95 -150.39 175.56 11.73 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.064 -1.425 . . . . 0.0 109.383 -177.705 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.52 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.8 m80 -93.37 137.64 32.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.526 171.144 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.525 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 ttp180 -61.03 -46.43 96.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.83 -170.693 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -50.36 -48.32 20.61 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.704 2.269 . . . . 0.0 113.496 166.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.77 -51.53 67.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.231 -166.376 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.462 HD12 ' CE1' ' A' ' 42' ' ' HIS . 3.2 tp -60.24 91.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.404 -162.13 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.7 mtpt -140.96 154.18 45.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.357 -169.372 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.0 t -69.45 132.05 45.72 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.376 176.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 45.1 mm-40 -95.43 31.31 2.01 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.194 -1.367 . . . . 0.0 110.261 173.437 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.33 -48.54 0.53 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.189 -174.343 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.1 p -114.1 -10.74 12.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.245 178.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.41 23.35 77.56 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 172.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . 1.1 tppt? -103.74 136.23 43.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.911 -0.645 . . . . 0.0 110.402 -177.602 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 m -61.94 142.56 57.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.451 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.527 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 60.1 mt -99.92 157.77 16.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.422 -173.082 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 -172.39 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.221 -167.748 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 -22.09 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.445 -167.59 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 174.68 60.76 0.05 OUTLIER Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 170.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -115.2 11.61 19.8 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 166.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.462 ' CE1' HD12 ' A' ' 28' ' ' LEU . 9.1 p80 -102.04 -168.61 1.56 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.389 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.36 158.64 11.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.958 161.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -121.18 138.99 53.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.1 -163.632 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.468 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 38.6 t60 -130.43 109.21 10.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.76 173.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' ' HD2' ' A' ' 48' ' ' LYS . 1.4 tp10 58.4 43.34 19.91 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.663 -170.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.84 22.65 73.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.489 ' HD2' ' HB3' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -117.64 98.43 51.7 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-N 115.159 -0.52 . . . . 0.0 109.759 173.195 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.7 Cg_endo -64.33 155.18 67.14 Favored 'Trans proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.62 2.213 . . . . 0.0 113.572 -173.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 76.3 m-85 -151.6 177.63 10.15 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.001 175.431 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.0 m -56.52 132.08 50.46 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.379 -1.737 . . . . 0.0 110.426 161.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.64 -30.06 69.64 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.978 163.332 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.447 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 34.4 m-70 -160.87 165.17 17.76 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.699 -1.137 . . . . 0.0 109.323 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.442 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.0 Cg_endo -72.89 -15.0 17.89 Favored 'Cis proline' 0 N--CA 1.483 0.898 0 C-N-CA 122.628 -1.822 . . . . 0.0 113.608 -13.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.6 m -59.54 -44.34 93.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.714 -157.02 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -61.78 -51.0 70.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.517 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -73.79 -15.25 61.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.342 -176.219 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.56 -56.03 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.354 173.421 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.3 tpt -72.1 -46.49 56.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.39 -170.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 18.0 m-85 -102.03 93.25 5.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.325 -171.665 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -138.02 141.26 11.94 Favored Glycine 0 CA--C 1.542 1.735 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -52.1 156.4 7.57 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.571 2.181 . . . . 0.0 113.555 -176.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.6 -54.4 2.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.321 169.785 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.6 -162.07 34.68 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -145.48 -80.39 0.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.364 -177.279 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.8 45.91 95.55 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 170.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.25 -80.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.195 -0.502 . . . . 0.0 110.356 -175.6 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.43 -88.63 0.65 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 170.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -163.77 169.23 38.66 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 -170.249 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.97 -14.55 15.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.152 -0.524 . . . . 0.0 110.311 176.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 58.59 -159.44 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.635 168.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.6 t 65.88 90.94 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.349 -168.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' CD2' ' N ' ' A' ' 73' ' ' HIS . 0.2 OUTLIER -157.41 79.79 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.379 170.263 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.0 p -96.16 -18.02 20.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.413 -178.052 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -111.23 -53.07 2.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.34 169.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.387 -170.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.5 0.538 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' HD3' ' HG2' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -119.52 155.99 31.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.413 -167.414 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.0 t -83.7 119.42 73.64 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.417 -164.887 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.6 Cg_endo -62.0 -17.78 57.87 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.794 2.329 . . . . 0.0 113.261 167.547 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -83.27 -76.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.449 179.593 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -92.79 -20.25 20.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.825 -163.19 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 t0 72.46 59.51 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.468 -171.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.53 -176.35 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.993 160.725 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.444 ' HG2' ' HD3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -98.26 148.0 24.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.528 172.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.514 HG21 ' NE2' ' A' ' 24' ' ' HIS . 38.1 t -111.96 112.96 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.546 -158.53 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 19.1 t80 -73.14 151.44 41.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.41 -179.343 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.41 -54.63 43.34 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.875 -159.211 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.91 -1.22 27.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.522 -170.115 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 13.22 28.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.339 175.73 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.45 153.49 22.45 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.283 -165.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 23' ' ' TRP . 18.0 m -147.84 147.57 17.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.787 156.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -113.84 136.06 53.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.666 -168.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.1 t -177.74 131.33 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.417 -173.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.46 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 3.1 mm? 60.12 36.0 21.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.719 -175.918 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.11 18.59 67.13 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.9 157.84 43.88 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 165.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -89.78 176.7 6.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.29 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -149.49 179.13 8.2 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.101 -177.041 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.9 m80 -96.27 142.99 27.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.445 170.66 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.514 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 15.0 tpt180 -61.28 -45.22 95.15 Favored Pre-proline 0 CA--C 1.543 0.689 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.728 -166.369 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.514 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.5 Cg_endo -64.81 -37.17 36.48 Favored 'Trans proline' 0 N--CA 1.483 0.893 0 C-N-CA 122.586 2.191 . . . . 0.0 113.604 175.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.522 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.4 m -61.08 -48.31 82.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.208 -166.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.471 HD21 HG22 ' A' ' 16' ' ' VAL . 6.6 tp -60.4 89.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.425 -163.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 39.5 mttt -143.46 144.06 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.3 -165.595 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.6 t -63.25 119.52 9.78 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.47 167.413 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 6.9 pt-20 -97.22 35.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.758 164.037 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -120.35 -48.71 2.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.205 173.161 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -112.6 -22.71 10.63 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 114.541 -1.208 . . . . 0.0 110.994 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.27 42.81 9.06 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -178.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -97.65 133.63 41.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.364 169.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.521 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 14.0 m -69.06 143.17 54.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.313 167.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 85.0 mt -109.19 158.88 17.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.262 -167.478 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -116.74 -169.05 1.56 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.549 -166.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.9 t -60.84 -23.1 64.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 -165.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.88 70.69 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -136.27 22.45 3.39 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 163.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 8.0 p80 -111.33 -168.43 1.31 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 114.792 -0.704 . . . . 0.0 110.486 -177.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -147.87 -166.64 2.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.776 165.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -163.13 137.81 6.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.077 162.624 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 85.6 t60 -103.09 112.68 25.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.831 166.053 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 58.28 31.7 21.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.742 165.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.35 -20.12 12.66 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.579 -1.008 . . . . 0.0 110.579 170.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -104.92 94.21 7.3 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 121.408 0.623 . . . . 0.0 109.853 -169.175 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.519 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.3 Cg_endo -64.44 158.07 51.37 Favored 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.374 2.05 . . . . 0.0 113.597 -177.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 88.2 m-85 -155.4 -164.6 1.8 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.074 174.304 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 98.1 m -56.48 135.52 54.31 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.435 161.458 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -61.12 -30.92 70.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.885 161.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 29.8 m-70 -161.65 164.97 17.21 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.333 165.915 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.411 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.3 -15.24 16.79 Favored 'Cis proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.529 -1.863 . . . . 0.0 113.555 -14.679 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.68 -40.34 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.657 -156.645 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -60.98 -35.61 77.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.471 172.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.1 t -84.58 -13.54 51.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.338 -174.295 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.78 -40.52 13.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.229 -177.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.34 -47.01 7.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.451 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 16.2 m-85 -120.37 100.59 7.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.341 -169.562 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -147.44 -136.71 2.84 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.29 -20.94 4.04 Favored 'Trans proline' 0 N--CA 1.485 0.98 0 C-N-CA 122.511 2.141 . . . . 0.0 113.549 171.401 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -166.94 168.44 13.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.435 168.801 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.61 -142.6 3.43 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -169.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.1 -76.99 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.368 -0.416 . . . . 0.0 110.37 170.268 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 90.51 -85.05 1.33 Allowed Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 170.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.16 96.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.418 169.805 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.54 85.77 0.29 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 178.247 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 138.28 -64.63 0.55 Allowed Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 170.238 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.73 -82.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.443 -0.378 . . . . 0.0 110.315 -169.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.88 157.54 18.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.073 168.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.7 t -91.83 -68.99 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.323 -169.273 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -127.85 -173.03 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.406 -169.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.98 87.76 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.422 -170.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -118.63 100.29 7.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.344 170.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.291 -170.087 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.524 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 7.1 Cg_exo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 113.528 0.549 . . . . 0.0 113.528 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -147.05 136.47 22.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.485 -166.458 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -93.52 118.77 67.6 Favored Pre-proline 0 C--O 1.247 0.957 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.157 -167.741 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.66 -27.43 84.81 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.839 2.359 . . . . 0.0 113.196 168.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -73.02 0.19 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.388 -176.441 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.14 -16.2 22.77 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -165.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.23 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.569 -169.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 -167.82 1.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.01 158.332 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.31 145.58 30.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.379 165.984 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 24' ' ' HIS . 48.5 t -107.71 110.25 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.746 -165.502 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -73.8 157.4 36.47 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -60.66 -63.13 1.4 Allowed 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.763 -160.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -3.83 19.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.372 -1.286 . . . . 0.0 111.79 -174.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.18 16.1 26.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 178.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -97.69 149.64 22.06 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.28 -163.543 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.477 HG22 HD23 ' A' ' 28' ' ' LEU . 12.5 m -142.2 119.07 6.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.483 154.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.7 m -88.05 133.36 33.99 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.287 -176.528 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.519 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.9 120.67 2.69 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.337 -161.047 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.7 mm? 60.02 18.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.721 -177.641 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.21 -26.11 12.77 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 162.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.77 147.49 43.82 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.873 -0.663 . . . . 0.0 109.95 178.85 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -79.06 177.51 8.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.191 -163.264 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 46.2 m95 -151.46 -178.32 6.6 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 113.972 -1.467 . . . . 0.0 109.371 -177.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.1 m80 -98.49 145.59 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.488 171.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -62.62 -49.9 80.82 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.833 -173.512 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.7 Cg_exo -61.56 -32.28 87.69 Favored 'Trans proline' 0 N--CA 1.482 0.835 0 C-N-CA 122.744 2.296 . . . . 0.0 113.604 176.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.444 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -70.2 -49.49 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.149 -168.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.477 HD23 HG22 ' A' ' 16' ' ' VAL . 5.3 tp -64.51 82.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.329 -162.771 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -124.24 142.47 51.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.301 -170.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.6 t -63.24 128.62 36.67 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.37 170.533 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 4.9 mm-40 -95.81 37.32 1.22 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.159 169.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.38 -50.39 0.56 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.257 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -112.19 -18.75 12.48 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.043 -179.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.42 40.27 60.33 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 174.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -111.88 134.98 53.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.154 -0.523 . . . . 0.0 110.495 171.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 m -61.56 147.13 46.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.381 176.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.515 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 11.4 mt -109.23 170.25 8.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.355 -166.907 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 m -108.01 174.57 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.424 -165.404 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.1 t -64.98 69.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.371 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.71 55.42 1.65 Allowed Glycine 0 CA--C 1.531 1.045 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.3 12.84 5.74 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.589 -0.605 . . . . 0.0 111.589 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.515 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 3.2 p80 -115.14 -168.93 1.46 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.781 -0.71 . . . . 0.0 110.257 -177.609 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.67 157.78 12.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.894 161.403 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.522 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.46 128.68 56.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.007 -163.851 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 60' ' ' PHE . 86.3 t60 -90.37 163.4 14.72 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.303 160.857 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.425 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 2.1 tt0 -60.43 92.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.119 -161.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.71 54.67 11.53 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.63 -169.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -179.74 101.84 0.18 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-O 121.451 0.643 . . . . 0.0 109.884 166.953 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.522 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.9 Cg_endo -65.1 150.25 88.06 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.803 2.335 . . . . 0.0 113.639 170.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 47.5 m-85 -147.61 -179.57 6.97 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.914 169.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.9 m -56.28 140.89 43.4 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.295 -1.775 . . . . 0.0 110.592 164.239 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -61.01 -32.95 72.52 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.12 168.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.438 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.5 m-70 -162.73 165.63 14.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.339 166.362 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -71.5 -11.33 15.39 Favored 'Cis proline' 0 C--N 1.354 0.831 0 C-N-CA 122.52 -1.866 . . . . 0.0 113.616 -14.344 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.528 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.4 m -59.82 -45.75 91.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 -157.842 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -61.28 -65.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.275 -178.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.438 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 73.1 m -65.27 -12.84 55.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.47 -170.237 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.58 -54.73 5.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.426 171.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -54.18 10.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.369 -169.258 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 45' ' ' HIS . 41.6 m-85 -114.17 99.42 7.61 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.327 -177.815 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.01 -61.63 0.19 Allowed Glycine 0 CA--C 1.542 1.741 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 172.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -60.65 -7.06 6.59 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 122.56 2.173 . . . . 0.0 113.495 -169.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -17.64 56.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.375 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.93 143.59 0.13 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 169.79 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -159.29 -52.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.308 170.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 177.36 177.13 46.01 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 170.323 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -115.49 163.05 16.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.352 -0.424 . . . . 0.0 110.333 -170.134 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.87 174.45 51.35 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -170.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 148.62 -22.86 1.33 Allowed Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -170.403 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.54 -168.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.277 169.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -115.39 77.92 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.052 -168.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.58 97.62 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.253 -169.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -71.67 -35.7 70.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.421 179.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.1 p -67.12 -85.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.439 -170.225 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -158.54 -73.78 0.08 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.436 -169.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.655 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.316 178.21 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.88 148.12 49.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.36 -171.386 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.3 t -76.09 118.33 70.44 Favored Pre-proline 0 C--O 1.246 0.906 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.505 -163.469 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -60.22 -18.62 53.03 Favored 'Trans proline' 0 N--CA 1.489 1.21 0 C-N-CA 122.96 2.44 . . . . 0.0 113.211 167.295 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -84.99 -77.4 0.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.46 -178.14 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.8 p -89.87 -13.07 37.21 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.455 -167.231 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 60.2 54.59 3.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.574 -173.16 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HA ' ' HD2' ' A' ' 8' ' ' LYS . 6.5 tptp -108.47 -168.37 1.35 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.767 157.081 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.96 155.3 18.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.595 161.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 ' NE2' ' A' ' 24' ' ' HIS . 38.7 t -114.24 113.28 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.504 -163.66 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.426 ' CE1' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t80 -73.35 157.79 36.3 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.359 177.076 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CE2' ' CE1' ' A' ' 11' ' ' TYR . 5.8 m-85 -60.55 -61.89 2.26 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.77 -159.819 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.38 -1.22 9.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.616 -173.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.533 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 15.8 mm-40 -101.96 12.98 36.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.69 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.24 152.12 18.64 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.277 -160.295 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.466 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.7 m -145.91 150.04 15.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.662 156.379 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 138.84 44.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.816 -170.677 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.458 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 27.8 t -177.3 132.76 0.17 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.341 178.007 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.15 38.0 20.51 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.533 -175.536 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.36 18.67 63.42 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 166.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -145.19 158.89 43.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.595 -0.302 . . . . 0.0 110.2 166.398 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.14 177.15 6.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.374 -167.729 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.84 -174.71 4.78 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 114.162 -1.381 . . . . 0.0 108.993 -177.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 45.0 m80 -100.9 142.38 32.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 113.803 -1.544 . . . . 0.0 110.555 170.136 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HG2' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -61.23 -44.81 94.67 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.116 -174.211 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 6.0 Cg_endo -62.65 -28.65 77.03 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.503 2.135 . . . . 0.0 113.652 175.417 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.4 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -77.32 -50.85 11.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.294 -168.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.2 75.78 0.05 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.301 -177.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.538 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 8.6 ttmt -147.52 139.54 24.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.431 -174.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.8 t -61.19 125.67 24.58 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.317 178.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.7 21.8 12.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.13 172.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.521 ' HG3' ' HE2' ' A' ' 59' ' ' MET . 0.0 OUTLIER -104.4 -58.6 1.86 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.162 166.063 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.5 p -102.31 -33.34 9.63 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.407 -172.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.51 49.51 4.6 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.506 178.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.504 ' NZ ' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -106.59 126.87 52.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.417 161.352 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.538 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 67.7 m -61.86 136.33 57.94 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.176 172.162 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 34.3 mt -96.43 165.91 11.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.371 -160.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.0 m -112.12 177.93 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.296 -164.076 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.8 m -60.72 84.04 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.526 170.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 55.79 7.31 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 172.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -132.03 12.23 5.32 Favored Glycine 0 CA--C 1.524 0.651 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.608 162.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.3 p80 -105.48 -168.53 1.47 Allowed 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 114.72 -0.74 . . . . 0.0 110.399 177.336 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.66 157.58 8.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.804 160.079 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.7 pt-20 -120.83 125.48 47.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.131 -161.576 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.506 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 83.4 t60 -93.4 164.65 13.12 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 158.178 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.413 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 15.3 mm-40 -58.09 93.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 -157.124 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.0 56.38 5.82 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.746 -172.313 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HE2' ' NZ ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER 179.14 98.86 0.17 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-O 121.755 0.788 . . . . 0.0 110.02 163.009 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 32.5 Cg_endo -68.52 137.84 40.41 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.974 2.449 . . . . 0.0 113.503 166.06 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.9 m-85 -133.85 -163.8 1.41 Allowed 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.67 171.383 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.9 m -56.37 134.16 53.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.451 163.521 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -60.93 -31.11 70.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.024 163.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.48 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 19.4 m-70 -158.62 166.39 16.57 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.206 164.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -66.26 -21.71 7.22 Favored 'Cis proline' 0 N--CA 1.49 1.276 0 C-N-CA 121.992 -2.087 . . . . 0.0 112.733 -20.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.9 m -56.54 -39.12 72.86 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.386 -152.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -64.73 -71.84 0.17 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.033 174.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.48 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 20.4 m -62.41 -14.16 37.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.54 -166.505 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.2 -50.92 5.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.236 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.521 ' HE2' ' HG3' ' A' ' 32' ' ' LYS . 4.2 mtm -98.84 -34.07 10.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.505 -161.155 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.506 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -73.71 87.29 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.386 -166.31 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.451 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -176.48 48.42 0.11 Allowed Glycine 0 CA--C 1.546 1.987 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 172.323 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.451 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 10.6 Cg_endo -63.24 -86.13 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.672 2.248 . . . . 0.0 113.641 -168.381 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.454 ' HE2' ' CZ ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER 64.84 -75.44 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.414 -166.11 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.12 119.41 0.01 OUTLIER Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -176.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.454 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 41.5 m-85 -111.08 26.21 10.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.444 -0.378 . . . . 0.0 110.282 -169.453 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.28 -65.52 0.5 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 169.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -23.34 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.27 -0.465 . . . . 0.0 110.439 -170.414 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.95 -140.45 6.6 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 179.266 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 104.75 -94.6 1.04 Allowed Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -171.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.62 117.29 0.02 OUTLIER 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.319 170.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.09 130.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.734 178.136 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.4 p -108.61 117.9 35.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.336 -169.039 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -111.29 144.7 40.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.337 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.409 HG23 ' CE2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -61.14 -81.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.412 -169.755 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.409 ' CE2' HG23 ' A' ' 74' ' ' THR . 1.1 p90 -152.2 140.72 20.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.411 178.023 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.359 -170.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.491 0.535 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -124.4 149.0 47.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.29 169.488 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.522 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.1 t -83.55 117.27 68.17 Favored Pre-proline 0 C--O 1.249 1.047 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.221 -162.347 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 5.5 Cg_endo -59.46 -23.08 69.1 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.418 2.079 . . . . 0.0 113.069 169.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -77.51 -72.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.545 -175.44 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.34 -20.45 19.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.755 -165.788 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.78 57.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.506 -172.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -118.57 -168.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.92 159.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.3 mp0 -104.35 154.14 20.19 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.434 160.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 31.7 t -112.27 111.99 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.45 -162.21 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.57 33.1 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.554 -1.203 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -51.21 70.81 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.007 -156.453 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -0.37 29.33 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.444 -168.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -111.05 20.96 16.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.304 173.084 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.84 148.0 24.86 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.355 -169.717 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.95 117.53 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.661 154.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -97.34 142.58 29.04 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.521 -173.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.6 t -177.26 137.36 0.22 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.212 -169.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.497 HD11 ' N ' ' A' ' 19' ' ' LEU . 4.7 mp 60.13 16.4 5.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.553 -172.874 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.6 -25.82 23.24 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 165.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.94 149.72 41.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 114.721 -0.739 . . . . 0.0 110.158 -178.135 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -85.76 177.53 7.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.217 -162.611 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 42.2 m95 -149.18 -175.84 5.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.376 179.27 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.522 ' NE2' HG21 ' A' ' 10' ' ' VAL . 45.6 m80 -98.22 148.52 23.52 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.468 173.389 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 tpp85 -61.58 -45.25 93.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.716 -168.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.0 Cg_endo -66.17 -40.28 15.87 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.538 2.159 . . . . 0.0 113.581 174.674 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.61 -53.26 59.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.301 -163.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -60.51 91.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.414 -163.015 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 mtmp? -152.18 148.05 27.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.353 -170.375 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.9 t -61.63 126.87 28.87 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.485 173.369 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.74 21.29 11.61 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.163 176.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.431 ' CE ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.13 -61.25 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.358 165.952 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.0 p -100.54 -22.76 14.88 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.569 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.53 45.18 11.34 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.537 -1.025 . . . . 0.0 110.537 -175.842 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -99.99 120.98 40.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.463 . . . . 0.0 110.298 165.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.5 m -61.23 131.0 49.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.302 175.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.533 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 21.3 mt -94.57 118.08 31.13 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 114.618 -1.173 . . . . 0.0 110.38 -174.024 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -60.15 -168.46 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.549 169.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -87.15 69.1 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.245 165.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 156.01 151.7 6.0 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.651 176.107 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.06 15.42 81.11 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.107 -1.044 . . . . 0.0 111.355 167.06 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -110.83 -166.51 1.08 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.722 -0.739 . . . . 0.0 110.853 172.343 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.95 159.63 9.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.191 -170.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.503 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -135.63 122.53 21.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.006 -165.092 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -128.86 102.15 6.41 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.197 -1.365 . . . . 0.0 109.972 177.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 58.6 47.47 13.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.643 -171.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.87 19.87 56.53 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.578 173.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -110.4 98.38 35.92 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 170.347 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.482 ' HB2' HD13 ' A' ' 37' ' ' LEU . 9.7 Cg_endo -62.17 157.82 42.78 Favored 'Trans proline' 0 N--CA 1.486 1.042 0 C-N-CA 122.47 2.113 . . . . 0.0 113.638 -173.14 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 57.0 m-85 -158.32 173.55 16.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.994 -170.528 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.4 m -57.87 130.88 48.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.051 160.201 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -61.52 -31.91 71.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.81 160.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.462 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.5 m-70 -157.12 163.2 25.82 Favored Pre-proline 0 CA--C 1.553 1.076 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.162 165.07 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -73.71 -16.73 18.65 Favored 'Cis proline' 0 C--N 1.353 0.788 0 C-N-CA 122.665 -1.806 . . . . 0.0 113.651 -13.316 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.6 m -59.36 -44.99 92.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.711 -156.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -60.83 -52.73 63.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.507 174.456 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.462 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 7.6 t -63.31 -29.15 70.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.38 -173.421 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.09 20.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -170.524 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.8 mmt -101.49 -39.28 7.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.508 -171.201 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -113.06 81.65 1.53 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 178.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -136.64 -165.67 10.59 Favored Glycine 0 CA--C 1.542 1.725 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -172.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -61.51 73.07 0.09 OUTLIER 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.565 2.176 . . . . 0.0 113.597 -177.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.27 84.95 1.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.393 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.32 43.51 1.67 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 174.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.488 ' CZ ' ' NH1' ' A' ' 67' ' ' ARG . 0.1 OUTLIER 176.81 -170.04 0.07 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.332 -168.829 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.9 108.96 0.91 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 169.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.488 ' NH1' ' CZ ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER 179.54 98.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.371 -0.415 . . . . 0.0 110.366 -170.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 170.14 -124.28 1.13 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 170.402 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 76.97 119.52 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -170.324 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.38 -52.87 62.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.218 -170.042 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -117.92 -158.42 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.962 -169.167 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 p -111.44 -170.93 1.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.422 -167.377 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 18.1 m80 62.28 78.34 0.29 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.431 -170.24 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.0 m -150.36 -86.35 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.179 174.111 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -129.61 -79.49 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.19 165.049 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.564 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.344 165.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.946 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.479 ' HG2' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.55 158.2 22.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -168.619 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.8 t -86.84 122.75 71.3 Favored Pre-proline 0 C--O 1.247 0.972 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.165 -162.445 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -62.03 -30.18 82.59 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.846 2.364 . . . . 0.0 113.288 168.971 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -70.87 0.28 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.476 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -96.65 -14.22 22.27 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.485 -166.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.5 57.12 3.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.58 -169.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.71 -168.01 1.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.853 158.929 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -107.69 152.14 24.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.608 162.013 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 42.9 t -111.2 112.47 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.615 -163.636 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.35 152.98 44.65 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.308 175.596 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -60.52 3.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.777 -158.759 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.53 -11.8 61.05 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.744 -172.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -102.81 42.6 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.173 170.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -108.82 152.72 24.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.384 -178.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.45 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 18.5 m -143.73 145.72 21.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.602 155.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.7 136.48 50.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.668 -166.204 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.435 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.0 t -177.99 136.45 0.17 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.466 -173.573 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.13 25.09 14.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.645 -177.671 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.75 -24.69 28.48 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 166.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HE2' ' HG2' ' A' ' 2' ' ' LYS . 3.3 tttp -118.09 165.98 13.11 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.752 -0.724 . . . . 0.0 110.21 -178.049 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.27 176.56 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.376 -166.293 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.4 m95 -148.53 -176.8 5.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 114.165 -1.379 . . . . 0.0 109.171 -178.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.519 ' NE2' HG21 ' A' ' 10' ' ' VAL . 45.4 m80 -102.98 141.83 35.11 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.473 169.309 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.96 -47.82 94.41 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.835 -174.549 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_exo -54.74 -27.3 51.43 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 C-N-CA 122.59 2.193 . . . . 0.0 113.609 172.624 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -83.38 -55.25 4.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.263 -167.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.418 HD21 HG23 ' A' ' 16' ' ' VAL . 3.4 tp -60.71 82.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.388 -171.126 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.75 144.9 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.393 -164.515 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.7 t -64.85 133.61 52.27 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.399 -171.281 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.34 25.42 6.28 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.439 175.143 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.499 ' HA ' ' NZ ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -130.68 -48.87 1.05 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.64 -179.597 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.8 p -109.68 -18.3 13.5 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.3 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.82 40.28 85.05 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 176.668 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.14 134.87 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.432 -0.384 . . . . 0.0 110.456 170.071 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.8 m -61.52 145.24 52.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.378 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.463 HD11 ' CB ' ' A' ' 42' ' ' HIS . 18.5 mt -106.9 143.31 35.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.398 -171.699 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -110.41 -169.45 1.47 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.523 -170.48 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.3 84.45 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 -167.476 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.87 55.52 4.12 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 167.39 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.58 12.28 4.58 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 167.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.463 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.3 p80 -108.09 -170.36 1.67 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.135 -0.533 . . . . 0.0 110.498 -178.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -177.96 157.13 1.12 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.423 161.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.461 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -136.96 153.25 50.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.07 -157.889 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.52 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 10.3 p80 -98.2 167.66 10.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.551 157.25 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.84 86.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.123 -170.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.49 -48.77 0.71 Allowed Glycine 0 CA--C 1.529 0.916 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.566 -178.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 3.6 mttt -137.33 111.53 9.17 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 121.439 0.638 . . . . 0.0 109.764 -160.225 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 15.3 Cg_endo -68.91 154.11 71.49 Favored 'Trans proline' 0 N--CA 1.484 0.959 0 C-N-CA 122.963 2.442 . . . . 0.0 113.599 167.805 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -143.21 -167.82 2.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.827 163.777 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.1 m -56.56 140.24 47.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.34 -1.754 . . . . 0.0 110.453 164.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.66 -34.81 74.85 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 114.407 -1.269 . . . . 0.0 110.118 164.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.52 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 41.3 m-70 -161.8 166.2 14.95 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.275 165.454 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.519 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.8 Cg_endo -71.81 -13.75 16.23 Favored 'Cis proline' 0 N--CA 1.481 0.783 0 C-N-CA 122.681 -1.8 . . . . 0.0 113.631 -12.309 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.1 m -59.68 -41.18 90.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.769 -157.194 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -61.17 -36.6 80.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.374 177.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.52 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -77.28 -28.48 53.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.342 -179.92 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.17 -45.32 7.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.317 -167.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.36 -34.41 75.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.354 170.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -96.51 29.28 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.298 172.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -170.11 56.8 0.19 Allowed Glycine 0 CA--C 1.544 1.853 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 171.304 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -59.36 133.1 50.19 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 C-N-CA 122.495 2.13 . . . . 0.0 113.561 -166.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.84 28.13 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.273 165.805 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.95 137.22 2.96 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 169.572 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 69.86 138.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.378 -0.411 . . . . 0.0 110.366 168.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 155.48 93.27 0.1 OUTLIER Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 170.346 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -158.88 -80.05 0.06 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.397 -0.401 . . . . 0.0 110.317 170.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.78 -169.23 54.95 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 169.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -120.7 97.31 0.64 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -170.082 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -161.78 -39.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.369 -0.416 . . . . 0.0 110.35 169.35 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 58.99 31.62 21.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.184 173.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 61.21 -163.93 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.331 169.249 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 71.8 129.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.453 -169.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.24 170.46 9.37 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.445 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 61.02 79.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.392 169.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.335 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.55 0.558 . . . . 0.0 113.55 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -125.5 153.53 43.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.458 -168.928 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.9 t -77.36 117.59 66.37 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.438 -163.813 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 2.0 Cg_endo -62.11 -9.92 16.31 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 123.001 2.467 . . . . 0.0 113.344 168.133 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.98 -74.38 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.446 -177.295 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -91.94 -19.35 22.54 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.973 -167.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.4 t0 72.3 49.17 0.23 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.594 -177.229 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -106.13 -168.39 1.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.839 159.325 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.1 mt-10 -107.03 157.49 17.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.457 158.565 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 24' ' ' HIS . 25.4 t -114.49 112.5 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.252 -159.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -73.79 159.51 32.81 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.189 -179.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -60.21 -63.08 1.43 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.85 -158.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -2.98 15.1 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.661 -174.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -101.79 15.59 28.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.264 178.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.41 138.96 36.76 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.478 -163.398 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.433 HG12 ' HA ' ' A' ' 25' ' ' ARG . 10.2 m -132.72 117.71 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.523 154.178 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 46.6 m -89.79 133.05 34.91 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.209 -176.117 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.514 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -161.51 125.91 3.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.376 -159.759 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.463 HD22 ' HG2' ' A' ' 44' ' ' GLU . 5.5 mp 59.98 19.67 8.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.764 167.137 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 124.42 -31.43 4.42 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 162.469 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -135.42 158.98 43.01 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 114.653 -0.774 . . . . 0.0 110.082 -177.188 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.32 178.06 8.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.236 -164.568 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 40.2 m95 -151.38 -177.48 6.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 113.791 -1.549 . . . . 0.0 109.216 -178.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 10' ' ' VAL . 44.0 m80 -99.63 147.83 24.96 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.485 171.799 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.49 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 10.6 mmt180 -61.16 -48.77 90.97 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.712 -168.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.49 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 3.6 Cg_exo -64.56 -36.19 44.15 Favored 'Trans proline' 0 N--CA 1.483 0.901 0 C-N-CA 122.618 2.212 . . . . 0.0 113.613 175.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 29' ' ' LYS . 1.6 m -64.59 -54.06 38.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -165.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.443 ' CD1' ' CD2' ' A' ' 23' ' ' TRP . 0.7 OUTLIER -62.73 90.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.374 -166.088 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.0 OUTLIER -140.74 152.03 44.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.414 -171.355 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -64.27 128.66 36.77 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.293 171.866 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 6.3 tp10 -95.7 35.25 1.39 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.199 171.859 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.47 -52.08 0.7 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.9 p -109.77 -17.57 13.64 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.17 -178.247 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.26 33.43 44.46 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.68 137.11 32.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.275 -0.462 . . . . 0.0 110.414 171.492 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.2 m -66.45 137.3 56.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.309 167.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.473 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 28.4 mt -100.05 149.95 22.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.394 -167.304 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -89.62 -162.42 0.88 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.63 -173.288 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -95.71 36.69 1.26 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.355 -174.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.2 57.83 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 164.486 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.68 12.97 4.52 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 166.37 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -111.66 -169.01 1.38 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 114.621 -0.789 . . . . 0.0 110.657 178.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HA ' HD23 ' A' ' 19' ' ' LEU . . . -169.55 159.39 8.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.995 164.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HG2' HD22 ' A' ' 19' ' ' LEU . 16.7 pt-20 -113.96 132.99 55.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.009 -161.677 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.498 ' CE1' ' CD1' ' A' ' 56' ' ' TYR . 0.7 OUTLIER -90.41 74.95 6.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.231 174.056 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 58.37 40.95 23.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.903 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.47 21.11 35.63 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.524 -1.03 . . . . 0.0 110.524 177.146 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.42 95.86 46.54 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-O 121.248 0.547 . . . . 0.0 109.794 168.294 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.456 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 9.3 Cg_endo -64.26 152.86 79.59 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 C-N-CA 122.577 2.185 . . . . 0.0 113.63 -167.49 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 90.9 m-85 -153.94 173.12 16.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.886 173.323 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 75.8 m -56.96 133.18 54.58 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.408 163.592 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -61.25 -35.28 76.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.075 163.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.458 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m-70 -153.02 167.32 13.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.25 163.05 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.458 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.2 Cg_endo -66.83 -21.4 7.77 Favored 'Cis proline' 0 N--CA 1.488 1.179 0 C-N-CA 122.394 -1.919 . . . . 0.0 112.807 -17.245 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.4 m -56.73 -48.79 76.98 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.282 -153.866 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.498 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 10.1 t80 -60.98 -49.76 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.505 -178.735 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 25.0 p -72.06 -19.15 61.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.461 -175.921 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.02 -55.3 4.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.178 -167.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 tpt -96.26 -19.91 18.94 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.219 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.461 ' HB3' ' CD1' ' A' ' 56' ' ' TYR . 0.3 OUTLIER -131.4 -167.25 1.83 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.886 -156.684 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.84 100.99 0.26 Allowed Glycine 0 CA--C 1.542 1.721 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 -168.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 57' ' ' SER . 2.9 Cg_endo -58.02 -32.01 94.34 Favored 'Trans proline' 0 N--CA 1.484 0.918 0 C-N-CA 122.654 2.236 . . . . 0.0 113.571 -177.072 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -77.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.366 -167.406 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 134.84 -116.23 1.55 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 171.09 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 69.05 -172.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.355 -0.423 . . . . 0.0 110.373 -169.711 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.42 -110.07 0.6 Allowed Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -170.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 ttp180 -60.98 168.9 2.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.363 -169.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 153.52 -24.34 0.75 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.201 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -60.99 145.44 48.28 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -170.166 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -149.94 -162.95 1.66 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.253 -169.833 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.56 167.13 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.66 -168.744 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 t -144.81 -164.26 1.88 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.355 -169.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -100.37 138.13 37.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.364 -169.73 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.2 t 60.47 35.28 20.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.909 175.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 70.64 143.37 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.285 170.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.597 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.371 170.162 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 113.516 0.545 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.96 134.39 44.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.419 -168.608 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 34.1 t -81.61 123.16 80.95 Favored Pre-proline 0 C--O 1.251 1.15 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.076 -165.304 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -63.8 -28.13 67.9 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 123.092 2.528 . . . . 0.0 113.25 169.852 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -70.61 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.415 -178.237 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -99.24 -26.08 14.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.716 -162.92 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.77 67.13 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.508 -167.58 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 6.9 tptp -125.51 -168.99 1.92 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.039 160.761 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -100.84 149.81 23.46 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.64 165.283 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 53.5 t -119.01 122.45 69.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.544 -163.518 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.498 ' HB3' ' HG3' ' A' ' 14' ' ' GLU . 26.9 t80 -88.36 152.09 22.16 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.387 -172.84 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.538 ' HA ' ' HG3' ' A' ' 15' ' ' ARG . 90.4 m-85 -58.44 -59.51 5.24 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.468 -154.077 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -13.98 59.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.653 -174.166 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.498 ' HG3' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -107.1 42.87 1.23 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.563 164.923 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.538 ' HG3' ' HA ' ' A' ' 12' ' ' PHE . 11.6 mtt85 -99.75 170.59 8.45 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.128 161.351 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.476 HG23 ' HB2' ' A' ' 23' ' ' TRP . 19.8 m -150.08 149.06 14.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.524 153.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -115.13 136.8 52.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.841 -167.624 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 t -178.57 126.89 0.11 Allowed 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.991 -165.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.529 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 mm? 59.39 19.15 7.44 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.74 -170.629 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.7 -24.46 30.77 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 166.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -105.11 158.3 16.67 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.033 -0.584 . . . . 0.0 110.159 178.009 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -91.48 176.88 6.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.259 -166.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.515 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 25.1 m95 -153.15 166.34 32.81 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 114.016 -1.447 . . . . 0.0 109.149 -176.42 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.6 m80 -83.04 136.93 34.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.588 168.347 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.445 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 6.9 mtp180 -60.88 -43.81 92.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.95 -172.404 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -59.51 -37.15 90.81 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.596 2.197 . . . . 0.0 113.638 172.515 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.3 m -69.22 -47.62 64.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.161 -167.08 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tp -60.6 86.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.391 -166.313 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.469 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.5 mtmm -145.46 142.17 29.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.367 -167.241 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -61.56 129.74 42.6 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.386 172.823 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -95.15 22.55 6.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.197 171.705 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -130.46 -35.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.464 -167.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.8 -17.78 5.78 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.342 171.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.46 41.45 51.79 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 177.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -109.11 136.97 47.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.437 172.384 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -61.04 148.37 40.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.472 177.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 93.2 mt -110.41 135.1 51.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.316 -168.012 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -93.46 -168.32 1.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.488 -167.091 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -60.66 -29.46 69.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.554 -164.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.82 62.03 0.1 Allowed Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -173.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.76 11.63 3.42 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.007 -0.596 . . . . 0.0 111.781 167.109 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 13.9 p80 -106.83 -169.45 1.55 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.823 -0.689 . . . . 0.0 110.711 178.887 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -149.51 -166.91 2.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.586 164.685 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.529 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 8.4 pt-20 -133.03 135.68 45.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.405 166.865 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.5 ' HB2' ' CE2' ' A' ' 60' ' ' PHE . 86.3 t60 -103.14 161.77 13.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 157.637 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -60.36 91.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.243 -159.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 136.91 -52.1 0.78 Allowed Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -174.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.0 144.52 35.51 Favored Pre-proline 0 C--O 1.242 0.695 0 CA-C-O 121.324 0.583 . . . . 0.0 109.939 -160.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.514 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -69.45 162.93 39.96 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.952 2.434 . . . . 0.0 113.675 169.527 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 94.2 m-85 -156.3 -170.76 3.46 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.913 166.274 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.1 m -58.0 130.47 46.69 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.755 -1.566 . . . . 0.0 110.117 163.666 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -60.64 -32.66 71.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.993 163.56 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 30.7 m-70 -158.65 162.77 26.02 Favored Pre-proline 0 CA--C 1.551 0.991 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.254 162.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.408 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -73.61 -18.76 16.74 Favored 'Cis proline' 0 C--N 1.354 0.838 0 C-N-CA 122.651 -1.812 . . . . 0.0 113.829 -11.365 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.6 m -58.84 -43.08 90.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.961 -154.757 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -61.22 -60.19 4.14 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.32 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 36.7 t -65.4 -24.12 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.45 -173.518 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.9 -48.41 4.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.222 -166.847 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.428 ' CE ' ' CZ ' ' A' ' 65' ' ' PHE . 46.8 mtp -104.0 -13.67 16.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.655 -161.334 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.5 ' CE2' ' HB2' ' A' ' 45' ' ' HIS . 4.6 m-85 -82.54 79.32 9.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.095 163.498 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.14 81.84 0.03 OUTLIER Glycine 0 CA--C 1.544 1.894 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 -167.187 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -52.46 -177.48 0.03 OUTLIER 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.47 2.113 . . . . 0.0 113.555 -166.184 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 tptm 63.92 113.83 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.371 -178.052 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 103.37 73.81 0.98 Allowed Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 169.014 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CD2' ' N ' ' A' ' 66' ' ' GLY . 64.8 t80 173.22 162.37 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.568 . . . . 0.0 110.397 175.755 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.474 ' N ' ' CD2' ' A' ' 65' ' ' PHE . . . 107.11 -109.61 3.07 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 168.391 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -61.09 146.15 48.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.463 -0.368 . . . . 0.0 110.319 -168.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 150.6 45.31 0.02 OUTLIER Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 170.191 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -119.91 -144.37 7.2 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -170.008 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.62 138.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.09 0.472 . . . . 0.0 110.399 -173.474 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -62.07 100.65 0.17 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.011 -169.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.71 -42.91 0.44 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.446 177.484 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.43 163.1 7.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.495 179.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.08 -60.87 0.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.4 -169.812 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 66.3 -76.31 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.356 -169.58 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt . . . . . 0 C--O 1.241 0.62 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.469 169.841 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.965 0 N-CA-C 113.588 0.572 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.68 157.35 28.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.453 -169.658 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.8 t -84.08 118.07 70.32 Favored Pre-proline 0 C--O 1.25 1.106 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.166 -162.279 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -60.03 -21.88 67.06 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.625 2.217 . . . . 0.0 113.106 170.051 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.48 -74.3 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.343 -176.647 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.37 -20.82 19.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.665 -165.111 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.8 t0 72.24 56.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.453 -171.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -116.45 -167.86 1.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.999 160.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.49 149.35 26.28 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.259 163.274 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.514 HG21 ' NE2' ' A' ' 24' ' ' HIS . 44.3 t -110.2 111.2 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.636 -164.785 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -78.81 163.73 25.1 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.318 179.831 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -60.52 -63.53 1.27 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.724 -159.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.19 -10.95 60.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.785 -174.534 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.6 44.3 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.238 170.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.55 141.44 47.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.607 -177.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.435 ' CG1' ' HD3' ' A' ' 25' ' ' ARG . 11.5 m -136.8 117.47 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.283 151.596 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -88.82 133.07 34.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.249 -175.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.7 121.37 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.435 -159.661 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.514 HD22 ' HG3' ' A' ' 44' ' ' GLU . 5.5 mp 59.87 27.12 16.41 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.8 166.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.03 19.17 29.44 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 162.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' NZ ' ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -171.09 154.57 4.12 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 164.694 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.7 OUTLIER -80.15 176.68 9.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.261 -163.562 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' NE1' ' HB2' ' A' ' 18' ' ' SER . 38.1 m95 -151.86 -176.12 5.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.353 -176.812 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.517 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.6 m80 -100.75 146.7 26.91 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.479 171.489 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.538 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.8 tpp85 -63.53 -47.31 83.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.831 -169.524 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.538 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -62.95 -31.45 77.07 Favored 'Trans proline' 0 N--CA 1.483 0.912 0 C-N-CA 122.525 2.15 . . . . 0.0 113.612 175.661 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -70.1 -43.94 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.188 -165.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD21 HG23 ' A' ' 16' ' ' VAL . 5.5 tp -69.04 77.59 0.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.27 -164.253 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 4.7 mtmt -137.44 149.65 47.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.412 -166.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -69.76 127.55 33.33 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.45 -178.517 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.65 18.35 20.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.712 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.421 ' HG3' ' HB3' ' A' ' 55' ' ' CYS . 19.4 mmmt -101.3 -60.16 1.57 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.356 162.215 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.3 p -103.65 -35.9 8.09 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 -167.538 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.28 49.73 3.18 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 179.149 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.47 ' HE3' ' CD2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -105.25 142.0 35.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.389 160.817 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.512 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 90.4 m -69.08 151.96 45.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.262 167.059 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.1 mt -116.94 156.92 26.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.26 -169.535 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -104.28 -168.21 1.46 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.627 -173.375 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.0 p -60.85 -26.38 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.547 -166.121 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.22 65.98 0.12 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -172.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.78 16.61 2.41 Favored Glycine 0 CA--C 1.521 0.443 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 168.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.521 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 10.3 p80 -111.93 -169.35 1.45 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.632 -177.286 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -144.24 -164.0 1.8 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.557 165.364 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.528 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -167.05 157.27 11.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.307 163.062 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.438 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 33.6 p80 -134.08 123.34 24.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.321 162.854 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 58.32 37.68 25.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.906 -178.841 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.09 23.15 69.51 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 165.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.64 99.95 25.92 Favored Pre-proline 0 C--O 1.244 0.784 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 168.672 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.8 Cg_endo -67.69 168.28 18.83 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.524 2.149 . . . . 0.0 113.614 -172.385 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -152.98 -165.04 2.08 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.075 166.252 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.1 m -56.85 131.12 48.53 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.141 -1.39 . . . . 0.0 110.258 161.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -33.08 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.845 160.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.45 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 27.5 m-70 -156.66 163.68 24.18 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.23 163.591 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.448 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.85 -17.63 18.09 Favored 'Cis proline' 0 N--CA 1.481 0.757 0 C-N-CA 122.705 -1.79 . . . . 0.0 113.631 -12.019 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.3 m -59.35 -44.03 92.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.796 -155.778 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.98 -54.39 45.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.467 178.161 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -72.7 -35.24 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.323 -169.296 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.36 -47.96 58.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.36 -177.086 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.401 ' HE1' ' HB2' ' A' ' 59' ' ' MET . 4.2 tpp -77.01 -34.76 57.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.442 -170.066 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -65.95 82.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.306 -171.055 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 146.71 63.66 0.01 OUTLIER Glycine 0 CA--C 1.543 1.808 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -176.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -56.61 146.31 76.65 Favored 'Trans proline' 0 N--CA 1.486 1.058 0 C-N-CA 122.396 2.064 . . . . 0.0 113.464 172.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.3 147.28 20.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.346 168.61 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.08 -59.48 3.51 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 170.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -82.3 111.74 18.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.283 -0.458 . . . . 0.0 110.182 -169.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.93 -122.44 1.87 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 170.196 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 63.37 108.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.299 170.158 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -95.75 -124.06 4.35 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 170.21 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 179.89 96.21 0.1 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 170.265 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.24 139.93 30.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.341 -170.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 58.56 102.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.597 168.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.9 p -82.74 -84.53 0.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.432 169.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -127.68 -43.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.368 -169.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.6 p -145.55 118.33 8.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.38 170.54 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.69 92.64 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.322 -178.361 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? . . . . . 0 C--O 1.241 0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.385 -173.536 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.472 ' HD2' ' HD3' ' A' ' 21' ' ' LYS . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.076 0 N-CA-C 113.486 0.533 . . . . 0.0 113.486 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -126.22 159.61 32.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.409 -171.225 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -86.08 119.27 71.62 Favored Pre-proline 0 C--O 1.249 1.046 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.199 -167.228 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -59.4 -23.75 71.67 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.655 2.237 . . . . 0.0 113.19 169.552 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -73.21 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.409 -178.53 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -97.69 -21.59 16.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.712 -161.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 73.42 67.18 0.1 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.559 -170.404 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.13 -171.19 2.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.102 159.618 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -102.22 154.94 18.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.757 166.232 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.512 HG21 ' NE2' ' A' ' 24' ' ' HIS . 59.1 t -124.19 112.03 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.828 -160.845 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.533 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.3 t80 -73.83 164.79 26.17 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.376 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -60.74 -56.93 15.32 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.798 -160.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.93 59.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.438 -1.255 . . . . 0.0 111.621 -174.311 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.533 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 6.3 pt-20 -111.2 37.81 2.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.965 163.921 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HA ' ' CG1' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -119.33 131.23 55.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.039 164.135 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 29.1 m -109.58 178.51 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.525 156.718 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.67 142.61 51.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.662 -176.461 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.6 t -177.77 136.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.376 170.545 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.467 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.2 mm? 60.08 29.12 18.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.593 -173.481 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.41 18.15 73.19 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 168.259 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HD3' ' HD2' ' A' ' 1' ' ' PRO . 9.0 mmtp -142.86 150.97 40.57 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 164.52 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -81.3 178.33 8.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.314 -164.102 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 27.3 m95 -151.08 160.18 44.05 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.4 -179.347 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 38.5 m80 -78.19 136.21 37.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.365 166.27 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.515 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.79 -43.86 93.19 Favored Pre-proline 0 CA--C 1.545 0.763 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.786 -170.87 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 5.0 Cg_endo -64.07 -23.79 67.04 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.351 2.034 . . . . 0.0 113.604 175.71 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.38 -45.62 21.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.313 -173.086 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.23 91.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.907 . . . . 0.0 110.346 -170.19 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 5.1 mtmt -152.6 141.56 21.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.385 -167.591 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -61.79 126.26 26.73 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.471 171.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 13.4 tp10 -97.21 20.32 11.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 170.942 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.525 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -107.36 -62.34 1.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.189 165.86 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.6 p -102.46 -19.17 15.02 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.776 -168.39 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.39 34.92 30.96 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.306 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -88.83 126.9 35.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.307 169.524 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.533 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 94.4 m -60.91 135.6 57.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.211 163.831 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 81.2 mt -99.49 104.43 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.387 -163.528 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -111.1 -168.63 1.33 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.395 -169.123 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 40.5 t 58.63 -89.02 0.02 OUTLIER 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.731 162.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.96 47.32 0.07 OUTLIER Glycine 0 CA--C 1.529 0.931 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 159.35 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -116.28 20.2 12.72 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -163.175 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.2 p80 -101.4 -169.57 1.71 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.916 -0.642 . . . . 0.0 110.711 177.011 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -175.41 159.51 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.14 167.803 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.467 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -117.62 137.45 52.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.068 -162.495 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.5 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 33.0 t60 -117.81 116.12 26.36 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 158.75 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.425 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 1.4 mt-10 60.74 -148.04 0.44 Allowed 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.439 -151.343 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -95.56 36.36 3.86 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 165.686 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.425 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -109.55 88.33 6.19 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-O 121.241 0.544 . . . . 0.0 109.786 171.757 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.3 Cg_endo -65.89 154.2 74.93 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.493 2.128 . . . . 0.0 113.58 -176.496 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.8 m-85 -148.16 -165.81 2.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.795 164.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 80.5 m -59.22 135.82 57.76 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.938 161.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -60.33 -34.72 74.22 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.254 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.9 m-70 -156.09 172.85 5.52 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.313 164.162 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.524 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.0 Cg_endo -63.35 -18.02 5.2 Favored 'Cis proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.431 -2.32 . . . . 0.0 112.533 -22.263 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.8 m -57.19 -45.2 83.93 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.221 -154.644 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -60.88 -49.03 79.11 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.317 -174.328 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -42.24 77.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.495 178.145 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.72 -50.36 30.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 -170.216 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.459 ' CG ' ' HD3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -61.04 -60.09 4.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.439 -179.741 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.5 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 1.3 m-85 -60.73 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.387 -161.969 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.33 103.11 0.24 Allowed Glycine 0 CA--C 1.545 1.959 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 175.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -49.15 90.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 122.668 2.246 . . . . 0.0 113.535 -163.635 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 18.9 mmtt 66.34 -78.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.552 165.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.03 86.29 0.06 OUTLIER Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -165.491 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 61.1 -169.31 0.17 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.122 0.487 . . . . 0.0 110.334 167.548 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.81 58.8 0.35 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.36 -1.096 . . . . 0.0 110.36 169.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.39 83.99 2.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.971 -0.615 . . . . 0.0 110.432 -179.022 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.33 132.85 10.58 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -170.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -68.36 -62.7 3.98 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 169.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.21 79.99 0.23 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.381 -0.409 . . . . 0.0 110.253 169.421 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -117.31 -18.16 9.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.075 -168.831 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.7 t -140.07 93.49 2.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.331 169.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 67.3 -80.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.41 169.561 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.5 -178.88 4.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.472 -169.825 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -85.82 168.56 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.383 -170.081 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? . . . . . 0 C--O 1.24 0.58 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.296 169.994 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.72 150.77 51.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.391 -168.958 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.512 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.4 t -84.47 117.6 69.11 Favored Pre-proline 0 C--O 1.25 1.127 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.253 -164.201 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.16 -20.08 66.33 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 C-N-CA 122.784 2.322 . . . . 0.0 113.254 170.056 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.516 ' HG3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -78.97 -73.48 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.464 -177.543 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.61 -21.98 18.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.527 -164.487 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 72.55 64.56 0.12 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.501 -169.061 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -125.38 -168.58 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.083 161.465 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.66 151.63 23.46 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.592 161.922 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.516 HG21 ' NE2' ' A' ' 24' ' ' HIS . 33.9 t -112.21 112.57 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.494 -161.296 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.78 151.43 35.98 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.251 179.381 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -60.22 -49.38 77.86 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.007 -158.398 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.3 -0.78 33.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.472 -167.487 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -104.24 4.39 33.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 174.378 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.57 152.88 33.77 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.312 -160.811 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.404 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 21.7 m -150.29 136.8 12.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.754 159.116 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.9 m -113.19 135.11 54.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.505 -165.603 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 t -178.01 136.01 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.536 -165.692 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 60.14 21.64 10.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.593 -174.42 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 16.89 79.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 169.407 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 158.84 43.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 163.15 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.06 176.84 7.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.249 -164.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 30.9 m95 -150.13 179.94 7.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 113.983 -1.462 . . . . 0.0 109.227 -179.275 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.516 ' NE2' HG21 ' A' ' 10' ' ' VAL . 41.8 m80 -96.03 150.88 19.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.425 166.559 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.536 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -61.48 -58.91 15.42 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.875 178.336 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 13.3 Cg_endo -54.28 -22.79 27.62 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 122.188 1.925 . . . . 0.0 113.619 -177.426 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.516 ' HB3' ' HG3' ' A' ' 5' ' ' LYS . 8.0 m -81.45 -53.97 5.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.382 -172.247 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.71 93.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.482 -161.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -142.49 146.67 34.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.408 -176.79 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -60.09 126.51 27.82 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.541 174.287 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.506 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 1.2 tt0 -94.75 27.7 2.97 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.104 172.116 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.539 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -124.19 -55.8 1.66 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.468 173.668 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.9 p -107.4 -21.8 12.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.832 -172.546 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.96 51.42 23.97 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -171.348 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 tptm -98.05 123.47 42.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.14 163.566 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.4 m -61.43 133.46 55.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.118 170.096 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' A' ' 37' ' ' LEU . 94.8 mt -98.2 138.03 36.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.426 -161.733 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 150.28 31.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.268 165.406 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.0 t -64.84 65.9 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.63 162.204 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.69 150.04 5.54 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.527 -164.536 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.82 14.74 82.05 Favored Glycine 0 C--N 1.344 0.986 0 C-N-CA 119.934 -1.127 . . . . 0.0 111.37 171.926 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.401 ' HB2' HD11 ' A' ' 37' ' ' LEU . 8.3 p80 -120.11 -167.03 1.37 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 113.993 -1.104 . . . . 0.0 110.809 175.141 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -156.66 -165.63 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.899 -173.442 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.4 172.76 5.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.99 164.206 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.474 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 34.4 p80 -130.83 104.73 7.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.353 162.406 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 58.45 42.8 20.56 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.884 177.023 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 110.67 -18.91 26.65 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 166.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -98.73 101.11 11.01 Favored Pre-proline 0 C--O 1.243 0.752 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 -170.934 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 10.6 Cg_endo -65.82 157.99 56.08 Favored 'Trans proline' 0 N--CA 1.487 1.109 0 C-N-CA 122.472 2.115 . . . . 0.0 113.533 -171.059 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 62.8 m-85 -152.45 -176.75 5.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.052 169.964 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 71.3 m -57.42 134.2 55.83 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.029 158.908 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -69.47 -29.5 67.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.761 160.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.9 m-70 -153.59 161.03 30.21 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.153 164.546 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.62 -16.79 18.45 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 122.685 -1.798 . . . . 0.0 113.675 -12.516 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -59.4 -53.45 58.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.752 -156.161 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -61.03 -48.1 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.5 178.762 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.1 p -65.53 -21.21 66.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.33 -176.762 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.18 -52.41 6.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.16 -168.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -106.82 -33.29 7.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.363 -174.89 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -90.93 -170.53 2.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.299 167.205 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -119.3 152.33 17.26 Favored Glycine 0 CA--C 1.543 1.818 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -173.252 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -59.04 140.39 95.06 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.363 2.042 . . . . 0.0 113.628 -178.55 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.86 -18.92 19.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.417 170.141 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.86 178.49 3.42 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -169.408 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -67.16 -172.95 0.23 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.474 -169.509 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 175.57 82.47 0.06 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 170.071 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -173.01 174.2 3.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.415 170.152 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -172.27 166.02 38.74 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 -170.229 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.99 -133.58 1.96 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 170.399 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.2 115.55 30.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.365 -0.418 . . . . 0.0 110.305 -169.907 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.4 138.99 57.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.009 -168.834 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.89 162.22 33.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.394 -169.379 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -64.6 -23.98 67.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.38 169.943 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.2 t 60.45 39.19 18.7 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.908 175.124 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 70.57 -76.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.233 -174.458 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 pttt . . . . . 0 C--O 1.24 0.566 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.432 -170.046 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.485 0.991 0 N-CA-C 113.503 0.54 . . . . 0.0 113.503 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -135.09 132.26 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.414 -175.191 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.9 t -80.68 121.69 81.44 Favored Pre-proline 0 C--O 1.251 1.134 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.029 -162.66 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -63.43 -27.13 70.63 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 C-N-CA 122.957 2.438 . . . . 0.0 113.311 174.256 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -73.3 0.25 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.288 -179.178 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.5 p -91.95 -22.86 19.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.748 -160.998 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.6 t0 72.39 67.74 0.13 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.482 -169.809 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 0.0 OUTLIER -127.17 -168.77 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.156 162.155 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 152.93 22.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.601 162.254 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.511 HG21 ' NE2' ' A' ' 24' ' ' HIS . 74.9 t -122.04 110.46 27.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.945 -163.765 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -73.32 162.54 29.23 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.423 -178.666 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.507 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.7 OUTLIER -60.97 -55.73 29.52 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.822 -161.594 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.48 -9.25 59.57 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.579 -174.195 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.52 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 2.2 mt-10 -112.49 35.79 3.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.129 163.38 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -119.08 136.39 54.17 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.097 165.253 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 m -123.76 135.56 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.514 156.42 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 3.4 m -103.57 138.43 40.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.485 -170.685 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.1 t -170.39 131.39 0.94 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.383 -166.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.462 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.8 mm? 59.99 17.58 6.79 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.571 -173.355 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.81 -25.37 22.82 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 165.35 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 148.52 43.62 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.773 -0.714 . . . . 0.0 110.232 -178.27 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -81.78 177.6 8.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.17 -164.071 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.9 m95 -151.09 163.81 37.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.048 -1.433 . . . . 0.0 109.377 -177.147 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.2 m80 -84.6 140.11 31.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.593 170.426 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HG2' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -61.26 -44.21 92.55 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.961 -167.524 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_exo -51.96 -47.73 25.11 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.752 2.301 . . . . 0.0 113.424 166.446 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 m -63.95 -46.01 86.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.467 -165.717 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.443 ' CD1' ' CE1' ' A' ' 42' ' ' HIS . 1.6 tp -62.4 92.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -169.993 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -143.3 140.08 30.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.392 -170.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 10.7 t -60.23 129.11 40.07 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.448 171.363 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -98.81 39.78 1.24 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.095 -1.412 . . . . 0.0 110.242 172.458 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -143.23 -43.8 0.29 Allowed 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.362 -175.674 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.2 p -115.25 -19.05 10.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.006 173.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.84 41.78 54.9 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 179.41 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.411 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.86 133.56 44.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.315 169.667 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.2 m -60.74 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.299 168.461 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 42' ' ' HIS . 96.5 mt -97.9 132.62 43.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.308 -164.82 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -106.03 -168.67 1.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.524 -166.246 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.6 t -60.91 89.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.433 -165.067 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.57 55.45 20.34 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 163.825 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.5 21.55 2.73 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 164.537 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.531 ' HB2' HD11 ' A' ' 37' ' ' LEU . 9.7 p80 -115.17 -166.9 1.16 Allowed 'General case' 0 CA--C 1.524 -0.057 0 CA-C-N 114.92 -0.64 . . . . 0.0 110.581 -176.747 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.4 -164.46 1.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.706 -169.452 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.4 148.89 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.177 163.065 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.514 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 9.1 p80 -91.13 165.35 13.54 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.458 157.051 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.68 87.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.1 -167.832 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 145.16 -61.5 0.49 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.581 -1.007 . . . . 0.0 110.581 -169.149 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -135.33 142.34 41.13 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-O 121.693 0.758 . . . . 0.0 109.78 -162.108 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.521 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 13.6 Cg_endo -72.42 158.31 51.56 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.865 2.377 . . . . 0.0 113.757 173.697 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 34.2 m-85 -147.0 178.01 8.69 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.946 168.74 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -56.44 140.44 45.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.474 163.25 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -60.66 -34.26 74.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.111 165.202 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.8 m-70 -162.63 166.42 13.73 Favored Pre-proline 0 CA--C 1.552 1.019 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.331 165.556 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.509 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -71.91 -13.15 16.54 Favored 'Cis proline' 0 C--N 1.353 0.774 0 C-N-CA 122.745 -1.773 . . . . 0.0 113.569 -12.7 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.8 m -59.82 -41.26 90.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.68 -157.286 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 62' ' ' PRO . 10.9 t80 -61.06 -38.2 85.36 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.367 176.856 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.519 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -75.77 -18.19 59.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.464 176.503 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.32 -54.14 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.143 -168.79 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.8 mmm -103.18 -25.16 13.47 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.338 -175.227 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.487 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 10.9 m-85 -117.05 -170.29 1.81 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.258 167.829 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -138.0 102.43 0.37 Allowed Glycine 0 CA--C 1.544 1.844 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.35 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' HA ' ' A' ' 57' ' ' SER . 1.6 Cg_endo -54.65 -60.33 0.62 Allowed 'Trans proline' 0 N--CA 1.487 1.089 0 C-N-CA 122.451 2.101 . . . . 0.0 113.502 -169.851 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 pttp 58.41 19.71 6.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.596 174.454 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.92 -121.44 4.34 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -171.01 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -76.6 -178.38 4.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.433 -0.384 . . . . 0.0 110.357 -168.85 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.37 -167.15 28.55 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 170.42 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 65.47 116.48 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.284 -0.458 . . . . 0.0 110.432 169.672 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.78 157.43 7.92 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 169.214 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.4 171.51 12.97 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 169.99 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.93 114.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.241 169.592 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 58.56 110.51 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.631 167.965 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.0 p -104.22 -164.26 1.04 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.36 168.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.0 179.93 4.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.342 170.063 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.7 p -144.69 25.04 1.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.452 -170.036 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -89.04 -64.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.332 -176.604 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.8 tptt . . . . . 0 C--O 1.24 0.601 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.372 170.083 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.461 ' CD ' ' HE2' ' A' ' 21' ' ' LYS . 5.6 Cg_endo . . . . . 0 N--CA 1.486 1.03 0 N-CA-C 113.562 0.562 . . . . 0.0 113.562 . . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 28.9 mttp -133.53 156.63 47.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.455 170.591 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.3 t -86.1 123.28 72.0 Favored Pre-proline 0 C--O 1.25 1.128 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.167 -164.355 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.514 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -62.65 -30.31 78.68 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.808 2.338 . . . . 0.0 113.164 169.424 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -69.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.495 -175.313 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -98.33 -22.58 16.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 -165.178 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.9 59.68 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.52 -171.543 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.466 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -124.59 -172.06 2.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.142 159.2 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.448 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -100.76 153.1 19.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.7 168.803 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 53.9 t -118.12 113.46 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.74 -164.261 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.513 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 34.9 p90 -82.17 163.88 21.64 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.359 -178.095 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.534 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 m-85 -58.12 -59.5 5.2 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.26 -153.288 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.35 -11.24 59.81 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.698 -174.615 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.513 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 14.4 mt-10 -108.2 46.2 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.807 164.32 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -118.59 141.34 48.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.699 161.91 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -136.81 131.52 47.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.712 157.695 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 34.3 m -97.98 144.19 27.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.481 -164.531 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.627 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 23.8 t -171.39 130.11 0.72 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.43 -171.035 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.481 HD23 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.17 15.08 4.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.698 -168.577 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.19 -24.58 31.57 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 170.661 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.461 ' HE2' ' CD ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -110.98 140.31 45.6 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 114.806 -0.697 . . . . 0.0 110.091 -178.897 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.54 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 5.6 m-20 -77.77 177.92 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.212 -161.299 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.514 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 31.7 m95 -150.59 171.15 17.56 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 113.82 -1.536 . . . . 0.0 109.279 179.739 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.519 ' NE2' HG21 ' A' ' 10' ' ' VAL . 44.4 m80 -88.75 149.14 23.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.506 174.925 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.527 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 tpp180 -61.32 -45.73 95.01 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.876 -170.975 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -64.24 -34.89 54.54 Favored 'Trans proline' 0 N--CA 1.484 0.956 0 C-N-CA 122.582 2.188 . . . . 0.0 113.601 174.378 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.31 -47.4 61.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.216 -164.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.518 HD22 ' CD2' ' A' ' 42' ' ' HIS . 2.5 tp -61.72 83.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.296 -168.444 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.509 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -144.88 152.0 39.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.442 -165.567 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -70.05 138.67 52.3 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.459 -177.777 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.494 ' HG3' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -89.65 -23.31 21.93 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.735 174.555 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.516 ' HD3' ' HE3' ' A' ' 59' ' ' MET . 2.2 tptp -71.08 -64.63 0.87 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.957 172.81 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.1 p -108.47 -19.79 13.33 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.965 -159.493 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.73 42.82 53.1 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 177.627 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.522 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -100.19 136.52 39.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.346 166.3 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 m -60.69 146.19 46.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.323 170.891 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 96.5 mt -110.38 153.05 25.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.288 -163.231 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 m -105.83 170.29 7.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.452 -163.569 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 t -61.64 -17.67 56.31 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.459 -168.344 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.91 57.19 0.14 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.97 11.61 3.63 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 114.917 -0.642 . . . . 0.0 111.753 166.889 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.627 ' HE1' ' OG ' ' A' ' 18' ' ' SER . 27.6 p80 -111.11 -169.8 1.52 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.144 0.497 . . . . 0.0 111.007 -177.662 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -154.24 -165.14 2.01 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.871 167.949 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.507 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -171.84 158.41 4.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.126 171.516 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -123.2 172.76 8.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.957 157.947 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -61.42 91.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.192 -163.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.65 -65.77 0.34 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -169.181 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HD2' ' CE2' ' A' ' 50' ' ' TYR . 2.6 pttp -152.89 138.98 12.07 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-O 121.91 0.862 . . . . 0.0 109.961 -163.501 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 20.5 Cg_endo -69.28 170.01 16.98 Favored 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.934 2.422 . . . . 0.0 113.572 170.127 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -153.64 -164.99 2.02 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.908 162.859 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 89.0 m -57.19 136.82 56.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.259 159.973 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -31.93 71.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.938 163.606 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.514 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.9 m-70 -161.51 165.99 15.62 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.305 165.466 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -72.03 -14.25 16.56 Favored 'Cis proline' 0 N--CA 1.482 0.8 0 C-N-CA 122.557 -1.851 . . . . 0.0 113.582 -13.934 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.0 m -59.81 -42.3 93.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.682 -157.11 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 60' ' ' PHE . 11.4 t80 -61.0 -39.25 88.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.53 176.083 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 15.9 t -84.54 -12.42 54.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -173.901 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.31 -47.56 19.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.32 175.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.516 ' HE3' ' HD3' ' A' ' 32' ' ' LYS . 1.6 mpp? -81.71 -41.25 21.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.457 -170.112 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 56' ' ' TYR . 0.8 OUTLIER -61.26 90.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.327 -165.334 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -112.15 -153.2 11.99 Favored Glycine 0 CA--C 1.543 1.843 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 169.829 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -62.61 -12.32 27.72 Favored 'Trans proline' 0 N--CA 1.483 0.904 0 C-N-CA 122.463 2.109 . . . . 0.0 113.554 178.078 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HG2' ' N ' ' A' ' 64' ' ' GLY . 2.4 ttmm -61.04 148.4 40.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.414 -168.103 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.476 ' N ' ' HG2' ' A' ' 63' ' ' LYS . . . -148.4 -132.31 2.15 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 169.66 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 10.9 t80 178.79 -80.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.348 169.042 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.93 -153.33 17.4 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.277 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.469 ' HB3' ' NH1' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -61.14 -77.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.366 -169.229 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 167.89 -127.84 1.62 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -169.712 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.49 -158.3 18.21 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 170.547 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -133.12 -166.61 1.79 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.296 -169.763 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.92 -81.15 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.018 -168.791 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.5 p -177.61 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.465 169.113 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -173.44 29.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.414 -169.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.7 m -94.26 138.75 31.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.436 -177.167 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 66.8 -76.13 0.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.321 -170.124 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.8 mttp . . . . . 0 C--O 1.24 0.587 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.387 -170.078 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 141.02 46.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.388 -168.734 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.9 t -82.25 117.02 66.92 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.164 -163.917 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.83 -21.92 72.06 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.727 2.285 . . . . 0.0 113.216 170.049 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? -76.42 -71.1 0.41 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.482 -175.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.64 -22.72 16.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.582 -164.991 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.47 55.49 0.15 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.503 -171.38 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -117.5 -169.25 1.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.948 159.771 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.94 148.43 25.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.65 167.096 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.519 HG21 ' NE2' ' A' ' 24' ' ' HIS . 50.7 t -109.7 111.09 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.651 -167.053 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 34.7 t80 -74.79 159.03 32.47 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.306 178.01 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.463 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 6.7 m-85 -60.58 -62.38 1.9 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.75 -160.118 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -1.72 11.63 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.72 -173.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -102.27 14.06 32.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.379 178.625 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -96.6 151.41 19.63 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.33 -161.496 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.453 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.0 m -143.9 145.02 22.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.601 156.19 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.1 m -115.71 136.26 53.23 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.715 -166.965 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 t -178.43 128.69 0.12 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.195 -169.316 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.534 ' HG ' ' HB3' ' A' ' 44' ' ' GLU . 2.5 mm? 60.12 34.97 21.23 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.605 -172.479 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.46 18.13 60.68 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 168.119 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -141.4 155.3 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 165.284 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.95 176.58 6.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.403 -165.822 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 26.2 m95 -149.8 -177.88 6.14 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.24 -177.079 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.519 ' NE2' HG21 ' A' ' 10' ' ' VAL . 42.9 m80 -99.2 145.97 26.66 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.553 168.928 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.468 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.1 mtp180 -61.22 -48.65 91.05 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.726 -168.899 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -64.0 -34.8 57.68 Favored 'Trans proline' 0 N--CA 1.483 0.87 0 C-N-CA 122.492 2.128 . . . . 0.0 113.647 177.049 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.01 -45.39 89.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.338 -166.131 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.413 HD21 HG22 ' A' ' 16' ' ' VAL . 9.6 tp -60.41 93.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.316 -162.173 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.406 ' N ' HD13 ' A' ' 37' ' ' LEU . 2.2 mttt -141.02 153.58 45.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.331 -164.268 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -73.35 126.4 30.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.403 173.27 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.466 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 19.3 mt-10 -96.09 33.46 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.046 168.509 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.461 ' CE ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -128.05 -52.8 1.31 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.077 175.619 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.21 -18.81 13.21 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.018 -177.462 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.12 36.42 40.63 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.384 -1.086 . . . . 0.0 110.384 175.762 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -100.39 137.0 39.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.476 170.38 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -66.96 147.96 52.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.433 170.315 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 6.9 mt -113.08 154.25 26.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.269 -169.939 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.2 m -154.28 158.24 39.9 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.128 -160.597 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m 60.59 11.96 3.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.122 171.519 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 59.19 54.45 37.81 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.201 -1.159 . . . . 0.0 110.201 -159.406 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.82 6.61 83.5 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 114.634 -0.783 . . . . 0.0 111.959 177.675 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.538 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 5.6 p80 -107.07 -172.18 2.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.38 -166.195 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.88 -163.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.813 163.897 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.536 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.8 tt0 -147.86 133.85 19.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.258 176.497 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.487 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 86.4 t60 -135.14 125.28 26.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 162.936 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' HB3' ' HG2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER 60.27 -150.19 0.42 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 -152.753 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -96.0 32.46 6.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 166.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HG2' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -117.84 99.16 52.1 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-O 121.702 0.763 . . . . 0.0 109.799 170.724 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.536 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.0 Cg_endo -58.81 165.34 8.36 Favored 'Trans proline' 0 N--CA 1.486 1.04 0 C-N-CA 122.161 1.907 . . . . 0.0 113.649 173.302 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 81.1 m-85 -153.73 -165.46 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.072 171.311 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.524 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 72.4 m -57.45 133.21 55.0 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.351 162.543 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -60.7 -31.01 70.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.926 161.469 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.1 m-70 -159.4 162.24 25.94 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.115 163.858 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -74.28 -17.42 18.95 Favored 'Cis proline' 0 N--CA 1.482 0.805 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.552 -14.093 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.524 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.19 -37.05 76.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.796 -155.311 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -62.49 -60.63 3.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.384 172.079 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 1.6 m -71.74 -17.19 62.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.414 -166.2 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.98 -51.58 13.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.334 171.651 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.6 ttt -81.79 -43.32 18.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.382 -169.577 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.487 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 9.8 m-85 -118.09 113.83 22.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.35 171.033 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -61.0 141.48 48.26 Favored Glycine 0 CA--C 1.542 1.774 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 -168.408 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -62.43 98.72 0.19 Allowed 'Trans proline' 0 N--CA 1.484 0.965 0 C-N-CA 122.605 2.203 . . . . 0.0 113.494 -173.651 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -117.31 -17.69 10.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.553 170.158 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.34 -170.77 33.06 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 170.37 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' N ' ' CD1' ' A' ' 65' ' ' PHE . 1.5 p90 -137.6 -173.95 3.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.33 169.991 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.55 159.76 8.69 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 -170.143 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.449 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 0.3 OUTLIER 64.48 80.45 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.347 -0.426 . . . . 0.0 110.494 -169.985 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -86.1 104.35 2.87 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 177.75 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.81 -163.71 35.73 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -170.124 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.69 93.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.368 -0.416 . . . . 0.0 110.236 169.919 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.81 -13.52 24.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.092 168.448 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.41 38.19 5.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.373 178.202 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m170 -61.38 98.58 0.09 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.447 177.932 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.41 24.62 12.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.401 170.304 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -94.82 149.41 21.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.356 169.933 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.415 -170.068 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.486 1.064 0 N-CA-C 113.554 0.559 . . . . 0.0 113.554 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.511 ' HG2' ' NZ ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -144.36 144.31 31.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.375 169.635 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -87.79 118.89 70.28 Favored Pre-proline 0 C--O 1.251 1.136 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.135 -164.56 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -60.97 -27.15 84.35 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.712 2.275 . . . . 0.0 113.211 169.108 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -69.78 0.36 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.459 -173.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -96.59 -22.07 17.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.621 -166.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.05 53.73 0.19 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.45 -171.238 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 -167.91 1.25 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.001 160.674 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.48 149.09 26.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.269 162.803 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG23 ' CD2' ' A' ' 24' ' ' HIS . 52.0 t -109.62 111.15 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.667 -166.502 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.537 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.6 t80 -78.84 161.76 26.54 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.282 178.117 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.68 -62.64 1.73 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.966 -157.723 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -10.83 60.16 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.779 -173.681 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.537 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.8 pt-20 -103.04 43.09 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.189 171.15 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -111.84 147.31 36.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.548 -177.45 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -140.43 143.15 29.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.459 154.188 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.9 m -115.61 133.82 55.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.616 -166.617 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.1 t -178.3 136.68 0.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.333 -171.4 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.463 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 2.7 mm? 59.97 29.43 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.65 -172.992 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.23 17.33 70.06 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 167.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.511 ' NZ ' ' HG2' ' A' ' 2' ' ' LYS . 1.2 tttm -143.64 160.13 41.22 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 164.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.02 177.34 6.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.306 -165.686 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 27.6 m95 -151.94 -174.94 5.03 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.116 -178.84 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 42.8 m80 -101.4 146.99 26.87 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.543 169.546 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 51.1 ttp180 -60.98 -47.14 96.35 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.727 -168.75 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -63.43 -35.36 61.47 Favored 'Trans proline' 0 N--CA 1.484 0.936 0 C-N-CA 122.55 2.166 . . . . 0.0 113.576 175.483 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -67.1 -50.81 60.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.328 -163.236 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.37 89.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.339 -163.674 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.3 ttmm -147.57 141.96 26.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.321 -164.95 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.5 t -60.83 119.71 8.73 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.283 165.627 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -96.91 27.2 4.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.962 168.02 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.73 -55.71 2.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.092 169.165 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.3 p -106.96 -24.52 11.98 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.652 -174.351 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.79 45.3 7.3 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -177.436 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.24 124.87 46.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.304 168.137 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 m -61.0 139.48 58.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.269 168.109 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 75.0 mt -103.39 127.03 50.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.273 -165.371 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -69.57 -170.21 0.28 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.565 169.603 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -105.14 18.15 22.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.6 -168.474 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.62 58.71 0.09 OUTLIER Glycine 0 CA--C 1.531 1.048 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 162.334 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.25 10.98 1.56 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.88 168.446 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.533 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 14.6 p80 -113.4 -169.09 1.43 Allowed 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.415 -0.392 . . . . 0.0 110.868 -175.913 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.521 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -154.08 -164.17 1.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.909 168.201 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.3 pp20? -164.08 139.52 6.11 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.085 170.638 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CG ' ' CE1' ' A' ' 60' ' ' PHE . 57.0 t60 -95.3 161.99 13.86 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.3 159.951 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 28.6 mm-40 -61.44 88.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.049 -166.364 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.18 -66.0 0.35 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.304 -1.119 . . . . 0.0 110.304 -167.059 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.14 141.91 19.09 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.422 0.63 . . . . 0.0 109.82 -163.445 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.48 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.7 Cg_endo -68.44 160.05 50.82 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.967 2.445 . . . . 0.0 113.734 169.552 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 60.8 m-85 -147.63 -163.35 1.75 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.568 164.426 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.2 m -56.94 138.36 54.13 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.265 159.078 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.521 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 34.6 t30 -60.73 -35.84 77.37 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.988 164.113 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.459 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 27.4 m-70 -157.85 165.14 19.3 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.227 164.423 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -73.07 -15.36 18.1 Favored 'Cis proline' 0 C--N 1.354 0.868 0 C-N-CA 122.512 -1.87 . . . . 0.0 113.595 -14.192 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.8 m -59.61 -39.42 84.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.619 -156.636 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -61.15 -56.99 14.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.351 171.919 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.459 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -65.66 -26.52 67.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.399 -169.418 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.43 -42.32 11.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.321 -169.896 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -50.6 12.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.32 -175.302 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CG ' ' A' ' 45' ' ' HIS . 15.9 m-85 -94.01 90.36 6.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.388 -167.531 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -132.78 -99.27 0.71 Allowed Glycine 0 CA--C 1.545 1.922 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 170.366 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -57.78 172.13 1.25 Allowed 'Trans proline' 0 N--CA 1.488 1.147 0 C-N-CA 122.4 2.067 . . . . 0.0 113.368 167.075 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.1 tptt 179.89 -77.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.352 169.539 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.78 122.31 4.63 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 -168.17 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.3 t80 71.68 146.51 0.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.287 172.246 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 171.92 -72.33 0.1 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 170.383 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -143.44 141.67 30.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.377 -0.412 . . . . 0.0 110.355 169.96 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -157.47 153.47 24.69 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -178.386 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.37 165.54 13.73 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -178.329 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -122.5 29.76 6.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.256 169.885 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.55 165.64 12.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.1 168.841 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.8 t -106.9 -63.18 1.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.384 -169.197 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -159.28 -59.7 0.07 Allowed 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.414 177.851 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.5 p -64.95 156.11 32.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.494 169.998 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -118.4 20.24 13.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.36 -169.977 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.368 170.067 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo . . . . . 0 N--CA 1.486 1.044 0 N-CA-C 113.617 0.583 . . . . 0.0 113.617 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -143.9 152.83 41.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.461 -167.063 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -89.99 118.01 68.55 Favored Pre-proline 0 C--O 1.249 1.043 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.177 -165.657 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -57.89 -26.82 76.05 Favored 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.61 2.207 . . . . 0.0 113.175 168.933 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -73.41 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.417 -174.885 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -93.87 -21.8 19.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 -165.683 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 t0 72.59 58.63 0.13 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.526 -172.601 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.517 ' NZ ' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -119.74 -168.96 1.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.027 159.452 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.444 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 3.7 mt-10 -102.71 154.03 19.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.696 162.851 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG23 ' CD2' ' A' ' 24' ' ' HIS . 37.1 t -113.5 114.06 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.452 -162.85 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.62 154.79 41.51 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.365 177.125 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.65 -62.24 2.0 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.847 -159.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.44 -1.22 10.12 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.648 -173.399 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -102.57 14.09 32.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.466 178.315 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 153.27 17.97 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 -160.815 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.462 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.1 m -145.11 151.15 15.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.699 155.703 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -115.41 136.23 53.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.724 -168.726 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.502 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 23.1 t -177.84 135.75 0.18 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.279 -177.923 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.428 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 2.3 mm? 60.04 28.41 17.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -169.844 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.27 18.21 64.86 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 170.22 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -138.05 153.85 49.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 164.893 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.87 176.35 7.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.412 -165.973 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 29.4 m95 -147.52 -177.99 6.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.134 -176.907 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.521 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.3 m80 -100.96 141.36 33.96 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.965 -1.471 . . . . 0.0 110.526 167.691 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.517 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.35 84.97 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.827 -168.251 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -58.5 -35.65 98.4 Favored 'Trans proline' 0 N--CA 1.483 0.905 0 C-N-CA 122.608 2.205 . . . . 0.0 113.538 174.78 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.91 -43.5 98.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.114 -168.832 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.445 ' CD1' ' CE1' ' A' ' 42' ' ' HIS . 11.9 tp -63.29 86.62 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.455 -160.442 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -131.51 148.74 52.66 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.247 -167.982 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -75.22 129.41 37.42 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.345 172.322 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -98.05 41.87 1.11 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.163 166.581 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.513 ' HD3' ' HE2' ' A' ' 59' ' ' MET . 0.0 OUTLIER -143.55 -40.79 0.3 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.466 -176.949 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.06 -12.61 9.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.332 173.579 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.9 42.45 99.65 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -124.24 136.89 54.49 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 164.332 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 29' ' ' LYS . 2.7 t -61.37 -170.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.242 -169.142 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.0 mt -143.1 150.96 40.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.478 -163.671 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.05 -171.99 3.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.294 -164.019 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.6 p -64.39 77.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.323 166.12 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 53.96 9.42 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 178.642 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.59 12.93 10.96 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.469 -0.653 . . . . 0.0 111.469 165.791 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.8 p80 -102.56 -168.79 1.57 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.579 -0.81 . . . . 0.0 110.528 175.933 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.18 158.62 14.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.889 161.304 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -113.13 127.3 56.16 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.982 -163.2 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.493 ' CD2' ' HG3' ' A' ' 46' ' ' GLU . 86.3 t60 -121.48 130.24 53.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.675 160.279 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.493 ' HG3' ' CD2' ' A' ' 45' ' ' HIS . 3.2 mm-40 58.27 34.73 24.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.074 171.698 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 36.65 70.65 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 171.642 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.06 128.2 9.18 Favored Pre-proline 0 C--O 1.242 0.667 0 CA-C-O 121.655 0.741 . . . . 0.0 109.612 162.358 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -63.59 159.9 38.65 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 C-N-CA 122.567 2.178 . . . . 0.0 113.57 174.45 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 72.9 m-85 -151.47 -174.11 4.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.758 165.761 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.8 m -57.63 123.56 16.04 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 113.569 -1.65 . . . . 0.0 110.229 164.362 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -60.73 -28.65 68.84 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.11 -1.404 . . . . 0.0 109.931 165.095 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 22.3 m-70 -155.89 160.27 30.93 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.862 -1.063 . . . . 0.0 108.982 159.255 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -74.57 -20.24 16.26 Favored 'Cis proline' 0 C--N 1.354 0.839 0 C-N-CA 122.803 -1.749 . . . . 0.0 113.699 -11.994 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.9 m -58.91 -56.1 26.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.808 -155.449 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.48 ' CE1' ' CD2' ' A' ' 60' ' ' PHE . 7.0 t80 -61.06 -45.33 95.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.293 -179.772 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.431 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 17.2 t -61.02 -15.4 31.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.547 175.407 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.92 -54.67 4.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.184 -173.21 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.513 ' HE2' ' HD3' ' A' ' 32' ' ' LYS . 2.3 mtm -100.09 -35.3 9.73 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.248 -172.204 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.491 ' CE1' ' CG ' ' A' ' 45' ' ' HIS . 54.3 m-85 -107.36 -169.72 1.58 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.173 165.337 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -129.0 -152.23 7.62 Favored Glycine 0 CA--C 1.542 1.771 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 -174.534 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -56.14 -87.29 0.01 OUTLIER 'Trans proline' 0 N--CA 1.487 1.117 0 C-N-CA 122.371 2.048 . . . . 0.0 113.469 -171.104 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.488 ' HD2' ' CE2' ' A' ' 65' ' ' PHE . 1.5 mmmt -111.82 -78.56 0.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.427 176.988 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.41 -102.0 0.33 Allowed Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 166.973 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.488 ' CE2' ' HD2' ' A' ' 63' ' ' LYS . 2.0 m-85 60.62 76.01 0.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.184 -0.508 . . . . 0.0 110.595 -172.435 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 61.77 78.81 0.15 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 170.283 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.96 33.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.269 -0.466 . . . . 0.0 110.423 170.251 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.27 97.1 1.72 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 169.411 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.0 145.18 7.75 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 -170.661 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.49 -162.98 0.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.369 -176.115 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.43 75.65 0.38 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.722 -168.529 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.89 -28.63 9.98 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.462 -177.765 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 71.99 -60.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.415 170.775 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.0 m 69.99 88.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.416 169.693 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -93.91 -78.29 0.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.277 168.815 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.319 169.234 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.429 0.511 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.49 133.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.439 169.24 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.507 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.7 t -89.58 133.04 35.21 Favored Pre-proline 0 C--O 1.243 0.753 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.166 -165.36 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 6.3 Cg_exo -73.06 -26.78 14.67 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.246 2.631 . . . . 0.0 113.44 171.533 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 -64.41 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.297 -164.712 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -92.5 -28.9 16.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.371 -164.792 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 73.72 58.79 0.09 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.525 -165.832 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.83 -168.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.838 158.245 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -108.82 149.57 28.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.624 160.772 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.52 HG23 ' CD2' ' A' ' 24' ' ' HIS . 65.5 t -103.5 117.89 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.595 -167.662 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -91.88 55.12 2.59 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.951 -156.072 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 61.59 -79.09 0.02 OUTLIER 'General case' 0 C--N 1.34 0.155 0 CA-C-N 113.976 -1.466 . . . . 0.0 110.358 178.477 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.18 -2.12 36.11 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.512 -163.068 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.69 13.96 30.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.251 176.682 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.414 ' NH1' ' HG3' ' A' ' 15' ' ' ARG . 14.3 ptt85 -83.78 153.48 24.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.258 -164.974 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.26 122.18 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.741 157.362 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 88.4 m -98.59 135.81 39.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.408 -162.197 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -178.0 137.39 0.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.586 -167.594 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.23 25.92 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.548 -173.039 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.58 -24.2 24.42 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 165.868 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -127.33 139.72 52.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 114.703 -0.749 . . . . 0.0 110.029 -177.251 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -68.86 -179.17 1.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.338 -161.394 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 60.3 m95 -145.77 -177.6 5.67 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 113.59 -1.641 . . . . 0.0 109.396 178.659 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.52 ' CD2' HG23 ' A' ' 10' ' ' VAL . 47.9 m80 -100.49 143.73 30.32 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.616 168.83 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.528 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 21.7 ttp85 -63.57 -53.22 53.28 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.81 179.13 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.7 Cg_endo -53.25 -13.41 3.22 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 122.459 2.106 . . . . 0.0 113.612 172.296 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -96.38 -64.26 1.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.328 -179.171 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.519 HD13 ' CE1' ' A' ' 42' ' ' HIS . 0.8 OUTLIER -64.85 91.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.398 -166.418 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.518 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.85 170.68 17.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.234 168.638 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.5 t -60.79 150.62 32.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.326 168.373 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.9 mm-40 -118.74 25.7 10.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.732 160.063 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.47 -59.99 1.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.172 167.902 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -102.3 -48.44 4.19 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.645 -167.759 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.42 56.45 0.51 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 167.284 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -131.01 137.52 49.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.39 167.386 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.4 m -60.73 153.16 24.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.442 174.02 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.5 mt -113.54 153.38 28.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.404 -165.424 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.459 HG23 ' N ' ' A' ' 39' ' ' SER . 93.8 m -68.72 166.58 17.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.475 -178.025 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.459 ' N ' HG23 ' A' ' 38' ' ' THR . 66.4 m -62.4 77.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.415 170.175 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.3 55.2 3.53 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 172.291 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.36 11.53 4.98 Favored Glycine 0 CA--C 1.522 0.519 0 CA-C-N 115.102 -0.549 . . . . 0.0 111.777 166.172 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 3.9 p80 -99.45 -169.26 1.73 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.84 -0.68 . . . . 0.0 110.47 177.49 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -130.91 171.65 12.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.339 168.91 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.76 138.35 23.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.05 -170.879 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -121.61 114.79 21.67 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.437 -0.801 . . . . 0.0 108.858 164.797 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.73 -148.11 0.44 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.522 -152.408 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -95.35 35.0 4.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 166.923 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm -107.37 87.55 3.36 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 121.211 0.529 . . . . 0.0 109.756 169.229 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.467 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.0 Cg_endo -62.85 147.9 94.09 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 122.526 2.151 . . . . 0.0 113.552 -174.847 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.5 m-85 -144.95 -165.78 2.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.922 162.095 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 99.5 m -59.11 -178.01 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.703 171.534 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.84 -32.89 11.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.178 164.586 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 42.2 m-70 -164.75 165.97 11.75 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.03 -0.987 . . . . 0.0 109.541 171.472 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 Cg_endo -69.61 -6.48 9.21 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.635 -1.819 . . . . 0.0 113.604 -11.515 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.5 m -60.28 -51.05 71.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.425 -162.001 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -60.73 -37.42 81.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.416 -168.136 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 60.1 p -86.91 -21.66 26.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.515 -173.817 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.358 -170.232 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.3 ttt -105.21 -34.54 7.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.312 -171.621 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -96.33 29.5 2.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.405 -169.615 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.45 179.8 30.78 Favored Glycine 0 CA--C 1.542 1.733 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 176.245 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -58.2 -80.68 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.997 0 C-N-CA 122.55 2.167 . . . . 0.0 113.581 -173.543 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 171.9 1.14 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.358 -169.569 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -130.77 -136.52 3.97 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 170.494 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -143.56 175.15 10.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.369 -0.415 . . . . 0.0 110.398 170.16 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -81.9 108.48 2.91 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 178.257 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.2 mmm-85 64.74 -171.67 0.18 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.404 178.148 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 166.83 166.5 26.03 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 170.283 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.09 111.49 0.32 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 170.344 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -140.87 -45.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.451 -0.374 . . . . 0.0 110.192 -169.868 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.41 -171.07 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.042 -168.96 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.5 m 65.7 113.55 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.334 169.185 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.6 158.15 43.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.41 169.792 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.8 m 69.65 -80.62 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.427 -178.273 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.03 158.81 0.1 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.33 169.671 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.552 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.401 178.078 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.242 0 N-CA-C 113.369 0.488 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.539 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 2.1 ttmm 63.77 162.34 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.218 165.331 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.8 t -80.6 131.27 61.6 Favored Pre-proline 0 C--O 1.243 0.737 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.486 -163.256 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 5.2 Cg_exo -70.4 -9.11 25.17 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 123.223 2.616 . . . . 0.0 113.504 170.328 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -102.19 -72.55 0.68 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.332 -172.38 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -91.99 -21.85 20.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.524 -160.157 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 t0 73.63 61.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.507 -167.164 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.92 166.65 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.076 159.447 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.539 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -85.4 148.72 25.87 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.42 171.92 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.519 HG23 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -110.16 116.85 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.742 -160.341 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -168.39 1.17 Allowed 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -74.28 -84.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.509 -165.973 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.78 -10.39 58.2 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.193 -0.603 . . . . 0.0 111.713 -159.158 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -104.98 42.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.963 169.621 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.35 149.12 25.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.396 176.324 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 23' ' ' TRP . 18.5 m -148.85 144.71 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.065 162.05 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 m -114.99 135.85 53.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.378 -168.822 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.8 t -177.79 128.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.366 -168.859 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 44' ' ' GLU . 2.2 mm? 60.17 22.11 11.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.423 -170.77 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.4 -24.4 27.6 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 164.524 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -114.4 137.37 51.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 114.76 -0.72 . . . . 0.0 110.24 -177.192 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.67 178.51 5.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.32 -163.388 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.524 ' HB2' HG21 ' A' ' 16' ' ' VAL . 41.6 m95 -146.46 177.4 9.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.59 -177.311 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.519 ' CD2' HG23 ' A' ' 10' ' ' VAL . 42.7 m80 -98.21 137.55 36.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.463 169.501 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 10.1 ttp85 -60.8 -47.28 96.22 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.878 -170.702 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.6 Cg_exo -54.75 -35.77 88.71 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.576 2.184 . . . . 0.0 113.544 170.929 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.34 -54.2 13.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.317 -172.967 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.515 HD12 ' CE1' ' A' ' 42' ' ' HIS . 2.1 tp -62.67 96.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.322 -166.243 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HG3' HG21 ' A' ' 36' ' ' THR . 0.2 OUTLIER -139.82 177.88 7.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 166.863 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.4 t -61.37 170.33 1.83 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.114 164.553 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 1.8 pt-20 -140.45 20.85 2.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.652 160.08 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.518 ' HE2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -100.2 -57.65 2.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.271 167.577 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.62 -49.83 4.96 Favored 'General case' 0 CA--C 1.524 -0.05 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.525 -170.895 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.05 59.73 0.61 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 169.931 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.68 139.17 27.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.058 0.456 . . . . 0.0 110.457 166.857 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.526 HG21 ' HG3' ' A' ' 29' ' ' LYS . 1.8 m -61.49 171.62 1.42 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.437 -173.571 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.522 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 5.8 mt -129.05 -177.82 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.366 -170.858 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -109.31 -169.44 1.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.548 -170.154 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.5 t -61.32 -25.26 67.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.342 -170.059 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 173.37 70.52 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.79 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.57 10.7 8.53 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.615 -0.594 . . . . 0.0 111.615 166.134 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.515 ' CE1' HD12 ' A' ' 28' ' ' LEU . 6.1 p80 -90.63 -169.5 2.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.441 173.361 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.7 172.59 12.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.328 167.632 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 19' ' ' LEU . 0.4 OUTLIER -128.57 147.76 50.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.964 166.758 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.495 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 86.0 t60 -84.27 -79.37 0.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.837 170.112 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -171.12 73.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.928 167.738 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 155.88 -45.75 0.52 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.545 -174.652 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 2.4 mptp? -143.98 138.61 15.2 Favored Pre-proline 0 C--O 1.242 0.665 0 CA-C-O 121.489 0.661 . . . . 0.0 109.87 -170.927 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.516 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 19.7 Cg_endo -64.18 147.15 91.33 Favored 'Trans proline' 0 N--CA 1.486 1.046 0 C-N-CA 122.658 2.238 . . . . 0.0 113.58 171.012 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.7 m-85 -139.49 -168.12 2.4 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.868 163.814 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 57.3 m -58.42 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.548 166.959 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -102.91 -30.26 10.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.132 161.876 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.514 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.3 m-70 -168.46 165.48 7.46 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.412 171.646 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.501 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -70.13 -5.76 9.63 Favored 'Cis proline' 0 N--CA 1.482 0.816 0 C-N-CA 122.576 -1.843 . . . . 0.0 113.741 -10.825 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.6 m -60.07 -41.33 92.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.554 -161.467 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.31 -39.59 94.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.381 -169.335 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -98.65 -19.34 17.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.328 -168.046 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.22 -53.24 10.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.274 -167.811 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -86.49 -42.18 13.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.37 -168.339 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.495 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 1.3 m-85 -62.83 88.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.325 -167.542 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.7 61.13 0.01 OUTLIER Glycine 0 CA--C 1.544 1.903 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -171.227 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.52 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 5.5 Cg_endo -59.3 -88.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.487 1.117 0 C-N-CA 122.449 2.099 . . . . 0.0 113.51 -169.169 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.52 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -147.44 -175.21 4.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.344 -168.133 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -143.23 -110.02 0.73 Allowed Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 169.409 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 66.95 -80.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.366 169.509 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.01 125.41 32.32 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -169.932 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.485 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -118.07 -170.17 1.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.383 . . . . 0.0 110.363 170.193 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.9 -68.57 1.61 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 170.231 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 74.29 -91.02 0.72 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -170.137 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.48 -77.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.421 -177.087 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.0 mp0 58.95 -84.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.629 -167.351 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 61.54 95.43 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.463 -168.818 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.03 -171.4 3.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.431 177.194 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 t -130.36 -161.32 1.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.399 -170.044 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.32 126.66 28.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.391 -169.979 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.24 0.601 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.439 170.176 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 113.574 0.567 . . . . 0.0 113.574 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 8.4 mmtt -138.87 139.86 38.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.467 -170.38 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.514 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.1 t -97.76 122.5 54.79 Favored Pre-proline 0 C--O 1.243 0.711 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.202 -165.329 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.513 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 8.3 Cg_endo -61.78 -27.64 80.92 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 122.538 2.159 . . . . 0.0 113.024 172.1 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.75 -55.43 3.57 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.666 -155.977 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -92.03 -27.61 17.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.395 -177.488 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.95 68.29 0.1 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.504 -165.484 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 -167.69 1.86 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.017 160.394 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -110.34 149.54 30.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.114 162.419 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 50.5 t -108.68 130.52 61.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.813 -161.553 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.46 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.8 t80 -90.67 178.43 6.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.359 -178.832 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -64.11 -83.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.281 -167.0 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.8 -1.95 10.74 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.554 -161.872 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -102.77 18.32 21.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.21 178.843 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -98.09 146.51 25.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.276 -165.358 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.468 HG23 ' CD2' ' A' ' 28' ' ' LEU . 14.5 m -143.3 120.92 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.891 156.515 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 33.3 m -90.31 132.29 35.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.383 -178.559 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.474 ' HB3' ' HA2' ' A' ' 40' ' ' GLY . 0.0 OUTLIER -167.94 124.32 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.155 -162.004 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.437 ' HA ' HD11 ' A' ' 19' ' ' LEU . 1.9 mm? 60.28 24.84 14.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.574 -173.528 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 99.13 -25.43 28.25 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 161.221 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -121.77 138.54 54.33 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.848 -0.676 . . . . 0.0 109.976 178.569 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -73.06 178.6 4.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.37 -160.489 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' A' ' 5' ' ' LYS . 63.3 m95 -143.52 177.5 8.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.802 -176.377 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.522 ' NE2' HG21 ' A' ' 10' ' ' VAL . 43.2 m80 -102.43 139.48 37.97 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.307 168.056 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.519 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 ttt180 -61.04 -51.27 80.3 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.779 -168.242 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 10.3 Cg_endo -56.82 -28.97 79.31 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.489 2.126 . . . . 0.0 113.518 173.036 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -67.31 -64.64 0.81 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.311 177.511 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.515 HD13 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -64.57 94.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 -163.444 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.19 173.28 9.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.227 167.516 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -60.63 -178.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.187 166.259 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -135.01 18.8 3.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.736 160.45 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.6 -45.39 1.48 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.536 -168.096 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -107.12 -32.13 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.75 176.057 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.85 64.39 1.49 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 177.382 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.1 tttp -150.15 145.83 26.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.038 -0.581 . . . . 0.0 110.422 -178.537 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.73 153.31 43.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.461 -174.707 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.517 HD11 ' ND1' ' A' ' 42' ' ' HIS . 14.4 mt -122.06 141.12 51.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.339 -168.179 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -175.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.442 -169.348 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.432 ' HA ' ' HB ' ' A' ' 16' ' ' VAL . 11.8 p -67.61 72.55 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.407 169.557 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.474 ' HA2' ' HB3' ' A' ' 18' ' ' SER . . . 72.25 57.72 5.49 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 172.13 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -125.53 12.15 7.47 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 164.315 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.517 ' ND1' HD11 ' A' ' 37' ' ' LEU . 2.8 p80 -102.0 -170.31 1.8 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 114.606 -0.797 . . . . 0.0 110.411 176.104 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -126.9 -174.35 3.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.34 169.902 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -164.94 146.26 7.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.971 -168.664 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.486 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 60.8 t60 -113.73 -51.34 2.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.755 -168.161 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -171.15 99.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.101 165.9 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.25 12.66 32.35 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.649 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HG2' ' HG3' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -141.8 86.99 10.27 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 114.914 -0.643 . . . . 0.0 109.785 -175.632 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.1 Cg_endo -60.94 147.26 96.13 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.518 2.145 . . . . 0.0 113.608 -176.198 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 4.3 m-85 -135.51 -178.55 5.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.015 164.464 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.9 m -59.31 -178.42 0.06 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.652 172.331 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -97.37 -34.88 10.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.999 164.481 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.541 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.0 m-70 -154.73 173.94 4.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-O 122.135 0.969 . . . . 0.0 109.344 165.969 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.541 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.6 Cg_endo -62.29 -12.93 3.62 Favored 'Cis proline' 0 N--CA 1.498 1.743 0 C-N-CA 121.312 -2.37 . . . . 0.0 112.505 -20.699 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.4 m -58.15 -48.3 80.69 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.85 -158.628 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.76 -41.02 94.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.457 -168.81 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -77.76 -18.92 55.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.55 -176.911 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.24 47.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.215 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.9 ttp -116.14 -30.84 5.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.37 -169.245 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.486 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -113.73 94.92 5.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.414 -169.938 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.41 ' HA3' ' HD3' ' A' ' 62' ' ' PRO . . . -74.39 -104.54 0.09 OUTLIER Glycine 0 CA--C 1.543 1.811 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 174.48 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.41 ' HD3' ' HA3' ' A' ' 61' ' ' GLY . 2.7 Cg_exo -62.1 -86.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 122.566 2.178 . . . . 0.0 113.523 -173.733 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.11 176.98 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.325 -171.459 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.39 170.05 5.68 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.547 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 71.85 110.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.379 169.758 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.15 -19.96 15.24 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 169.717 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -174.99 109.42 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.34 -0.43 . . . . 0.0 110.381 169.988 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -157.16 136.14 4.76 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 -178.278 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.67 84.02 0.07 OUTLIER Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 170.268 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -137.74 14.85 2.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.397 -0.402 . . . . 0.0 110.304 170.249 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 58.48 179.66 0.07 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.681 -168.461 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.4 140.96 28.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.419 -169.301 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -149.03 158.52 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.318 169.947 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -63.66 -28.76 70.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.385 -170.182 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.18 25.06 11.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.315 -169.977 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.521 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.376 170.086 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.083 0 N-CA-C 113.418 0.507 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -148.23 165.51 30.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.388 -168.363 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.7 t -78.93 135.83 58.68 Favored Pre-proline 0 C--O 1.244 0.803 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.434 -162.489 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 4.6 Cg_exo -69.85 -26.39 27.19 Favored 'Trans proline' 0 N--CA 1.484 0.966 0 C-N-CA 123.437 2.758 . . . . 0.0 113.358 166.826 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.97 -65.85 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.365 -167.296 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -97.4 -25.84 15.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.577 -163.965 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.7 t70 72.77 69.7 0.13 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.504 -164.544 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.42 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 0.2 OUTLIER -129.6 -168.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.158 163.22 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.69 148.37 28.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.406 160.851 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' NE2' ' A' ' 24' ' ' HIS . 54.4 t -107.71 112.45 40.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.902 -165.919 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CZ ' ' A' ' 12' ' ' PHE . 17.7 t80 -66.95 160.91 25.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.354 176.342 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CZ ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -62.24 -76.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.221 -167.868 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.76 -0.31 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.45 -162.553 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -105.7 16.59 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.279 177.064 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.56 157.8 16.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.263 -166.148 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.507 HG21 ' HB2' ' A' ' 23' ' ' TRP . 18.2 m -147.89 123.09 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.82 160.393 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 84.9 m -100.62 135.28 42.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.443 -167.259 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 6.9 t -177.91 130.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.438 -166.061 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.537 ' HG ' ' HG3' ' A' ' 44' ' ' GLU . 2.4 mm? 60.04 37.69 21.03 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.663 -175.158 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.22 17.61 46.38 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 165.709 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -151.33 123.15 8.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.039 168.019 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.56 -179.34 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.351 -162.703 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 50.4 m95 -145.79 169.68 18.04 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.708 -178.077 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 46.2 m80 -92.85 144.02 25.69 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.52 170.245 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 ttp85 -61.16 -49.51 88.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 -169.833 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 2.9 Cg_exo -57.8 -33.68 97.23 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.692 2.261 . . . . 0.0 113.504 172.728 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.17 -55.81 8.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.28 -171.194 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD11 ' CG ' ' A' ' 23' ' ' TRP . 1.9 tp -60.7 87.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.345 -167.054 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.08 153.39 47.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.224 -170.874 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -65.6 171.38 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.441 164.688 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 38.6 tt0 -121.54 -21.64 6.16 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.707 173.322 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -94.7 -39.42 10.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.501 -167.53 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.9 p -105.98 -42.49 5.1 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.0 174.701 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.41 58.04 2.01 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 175.601 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.28 139.2 49.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.364 167.792 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 158.27 18.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.32 -176.645 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.6 mt -119.96 137.04 54.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.434 -166.235 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.474 HG23 ' N ' ' A' ' 39' ' ' SER . 39.4 m -67.61 169.76 8.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.523 -178.571 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.474 ' N ' HG23 ' A' ' 38' ' ' THR . 2.3 m -69.55 76.67 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.436 -175.27 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.28 56.64 1.44 Allowed Glycine 0 CA--C 1.529 0.918 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 169.633 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.8 10.72 3.68 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-N 114.908 -0.646 . . . . 0.0 111.824 166.972 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.516 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 2.8 p80 -103.54 -170.45 1.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.328 -177.102 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.452 ' HB1' ' ND2' ' A' ' 52' ' ' ASN . . . -132.51 -171.72 2.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.061 165.19 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.537 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -170.98 154.49 4.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.972 -172.624 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 14.4 p80 -105.86 -169.3 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.067 160.006 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -62.53 81.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.272 -177.424 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 124.18 -33.8 3.73 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 168.651 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.497 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.9 OUTLIER -124.51 109.1 28.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-O 121.574 0.702 . . . . 0.0 109.735 -165.199 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.5 Cg_endo -63.7 148.41 92.16 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.651 2.234 . . . . 0.0 113.642 173.122 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 5.1 m-85 -135.44 -168.03 2.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.815 165.684 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 52.8 m -58.45 -169.45 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.974 -1.467 . . . . 0.0 110.489 164.184 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.452 ' ND2' ' HB1' ' A' ' 43' ' ' ALA . 0.4 OUTLIER -100.77 -37.67 8.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.23 163.046 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 35.4 m-70 -157.79 172.8 5.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-O 122.195 0.998 . . . . 0.0 109.456 167.154 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.53 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 27.0 Cg_endo -63.59 -11.53 4.19 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.486 -2.297 . . . . 0.0 112.516 -19.081 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 58.6 m -58.27 -40.57 82.22 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.71 -158.615 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -61.12 -30.99 70.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.276 -172.714 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.3 t -108.26 24.16 13.43 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.488 176.468 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . -102.7 -64.65 1.05 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.246 -175.28 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.425 ' HG3' ' HE2' ' A' ' 32' ' ' LYS . 3.8 ttt -85.13 -19.64 31.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.414 -166.15 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.99 94.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.448 -167.109 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.439 ' N ' ' CD ' ' A' ' 62' ' ' PRO . . . -169.06 49.68 0.22 Allowed Glycine 0 CA--C 1.543 1.805 0 N-CA-C 109.811 -1.316 . . . . 0.0 109.811 171.884 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 61' ' ' GLY . 9.7 Cg_endo -61.76 -87.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.567 2.178 . . . . 0.0 113.593 -171.961 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.46 87.4 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.343 -167.999 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 174.16 113.56 0.32 Allowed Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -170.207 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.2 t80 176.2 158.87 0.28 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.399 -0.401 . . . . 0.0 110.335 169.733 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.91 152.51 39.6 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 170.296 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 9.7 tpt180 -109.6 32.91 4.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.302 -169.787 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -69.99 -27.24 73.3 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 -179.207 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 126.49 -162.0 20.72 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.471 -1.051 . . . . 0.0 110.471 170.339 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -168.96 94.12 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.417 -0.391 . . . . 0.0 110.252 169.854 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -151.34 88.61 1.45 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.061 168.753 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p 61.32 170.48 0.11 Allowed 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.489 -177.966 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 178.44 168.27 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.415 178.662 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.8 t 178.5 91.43 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.384 170.154 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 178.47 85.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.415 170.088 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.392 -170.023 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.636 0.591 . . . . 0.0 113.636 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.94 168.31 20.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.413 177.941 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 12.6 t -77.53 130.93 72.59 Favored Pre-proline 0 C--O 1.246 0.869 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.554 -163.092 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.522 ' HG3' ' HG3' ' A' ' 21' ' ' LYS . 4.1 Cg_exo -68.91 -14.82 39.47 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 C-N-CA 123.23 2.62 . . . . 0.0 113.397 168.679 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HE2' ' HD2' ' A' ' 49' ' ' PRO . 8.9 tptp -95.68 -72.36 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.235 -169.545 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -91.74 -23.17 19.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.568 -163.098 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 74.12 55.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 -167.621 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.27 176.91 6.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.699 155.915 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.85 151.26 19.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.783 171.997 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 70.5 t -113.25 111.05 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.852 -163.535 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.33 -167.99 1.04 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.405 -173.779 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -62.56 -83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.203 -164.934 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.58 -15.41 59.25 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.609 -163.233 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -95.87 41.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.98 174.348 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.4 140.88 47.69 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.598 170.781 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.521 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.3 m -131.32 134.32 61.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.838 159.285 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -103.01 139.06 39.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.422 -169.039 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.488 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 3.6 t -177.63 122.55 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.193 -165.965 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 44' ' ' GLU . 2.0 mm? 60.23 32.6 20.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.506 -171.218 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.42 61.69 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 164.163 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -145.15 125.52 13.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 164.204 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.94 179.81 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.411 -161.028 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.521 ' HB2' HG21 ' A' ' 16' ' ' VAL . 27.1 m95 -148.34 175.81 10.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 114.205 -1.361 . . . . 0.0 109.724 -176.916 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 46.2 m80 -95.35 150.26 20.46 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.563 172.24 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -50.09 86.12 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.873 -167.594 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -65.51 -36.19 35.28 Favored 'Trans proline' 0 N--CA 1.483 0.89 0 C-N-CA 122.696 2.264 . . . . 0.0 113.526 176.267 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.2 -47.12 87.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.201 -165.174 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.428 ' CD2' ' NE2' ' A' ' 42' ' ' HIS . 5.0 tp -59.96 92.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.402 -159.774 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -132.29 165.11 24.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.252 -171.257 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.9 t -61.4 179.39 0.22 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.307 172.333 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 2.6 tp10 -143.93 22.99 1.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.967 162.605 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.524 ' HE3' ' HB2' ' A' ' 59' ' ' MET . 0.8 OUTLIER -128.79 -37.23 1.76 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.719 -171.426 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.4 p -106.97 -48.3 3.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.483 165.938 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.99 58.32 0.88 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -169.648 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.6 141.39 46.61 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.966 -0.617 . . . . 0.0 110.459 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.533 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -74.66 152.67 39.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.405 -170.455 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 22.9 mt -117.87 161.13 20.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.336 -168.529 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.99 -175.01 2.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.367 -167.511 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 p -61.04 -18.68 59.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.383 -167.823 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.69 68.32 0.03 OUTLIER Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 169.548 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.08 10.55 5.93 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 167.356 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 3.8 p80 -93.0 -169.74 2.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.415 176.793 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -131.66 -168.79 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.142 168.286 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HB3' HD22 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -166.67 160.61 15.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.049 168.144 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.492 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.5 t60 -132.44 72.06 1.49 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.96 -177.335 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 58.4 87.17 0.08 Allowed 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.918 -179.603 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.81 -21.27 46.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 165.086 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.51 96.38 19.01 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.669 0.747 . . . . 0.0 109.866 -167.991 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.514 ' HD3' ' CH2' ' A' ' 23' ' ' TRP . 16.1 Cg_endo -59.49 142.67 99.29 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 122.256 1.97 . . . . 0.0 113.627 175.752 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 73.6 m-85 -135.72 -177.1 4.52 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.017 176.461 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 65.4 m -58.98 -178.21 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.526 168.344 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.78 -27.95 14.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.018 160.976 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.521 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 51.8 m-70 -169.52 166.53 5.78 Favored Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.497 172.119 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.521 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 Cg_endo -69.16 -6.75 8.6 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.574 -1.844 . . . . 0.0 113.673 -12.071 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HA ' ' HB1' ' A' ' 58' ' ' ALA . 66.4 m -60.52 -49.56 77.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.401 -162.727 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.92 -38.07 84.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.418 -171.455 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -106.07 32.91 4.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.496 170.208 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.515 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . -78.45 -66.81 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.284 169.742 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.524 ' HB2' ' HE3' ' A' ' 32' ' ' LYS . 2.5 ttm -108.64 -28.53 9.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.411 -169.778 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.492 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 3.7 m-85 -77.53 85.37 3.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.336 -170.016 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 148.15 66.1 0.01 OUTLIER Glycine 0 CA--C 1.544 1.854 0 N-CA-C 109.786 -1.325 . . . . 0.0 109.786 -171.435 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -54.11 101.36 0.07 OUTLIER 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 122.579 2.186 . . . . 0.0 113.534 -172.338 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER 178.55 -36.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.371 -170.318 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.79 -91.78 0.03 OUTLIER Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.172 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.7 124.44 23.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.242 170.174 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.2 97.88 0.67 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 170.142 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -103.32 -60.45 1.56 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.333 170.21 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 176.04 127.62 1.05 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 178.694 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -155.22 172.52 33.47 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -178.46 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.11 -60.29 1.9 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.439 -0.381 . . . . 0.0 110.341 169.835 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -123.79 -74.58 0.61 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.049 -168.965 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -126.76 -75.21 0.58 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.388 169.325 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -155.47 -80.38 0.08 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.405 170.039 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.6 p -164.33 -86.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.446 170.288 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -118.12 -43.0 2.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.326 170.019 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.514 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.415 -178.292 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.479 0.53 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp 63.71 156.68 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.343 170.614 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.4 t -80.46 132.33 59.04 Favored Pre-proline 0 C--O 1.244 0.787 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.408 -162.006 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.0 Cg_exo -69.06 -19.78 38.99 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 123.267 2.644 . . . . 0.0 113.312 167.128 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -70.86 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.353 -166.304 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -91.19 -24.07 20.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 -165.142 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 73.45 58.3 0.1 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.534 -167.48 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.5 -168.88 1.56 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.891 158.904 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.76 152.09 26.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.574 160.219 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.525 HG21 ' NE2' ' A' ' 24' ' ' HIS . 53.7 t -107.59 110.33 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.746 -163.845 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -74.43 178.23 5.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.151 -179.63 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -61.4 -84.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.567 -165.071 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -6.49 35.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.861 -158.802 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 17.71 11.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.287 -176.858 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 154.29 22.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.246 -163.971 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG1' ' HA ' ' A' ' 25' ' ' ARG . 11.4 m -148.31 121.88 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.254 161.025 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.7 m -102.5 135.4 44.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.389 -163.921 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.511 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 17.7 t -177.99 132.55 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.408 -166.625 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 60.1 34.68 21.27 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.65 -177.276 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.47 18.17 50.03 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 167.268 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -150.34 125.08 9.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.053 166.703 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.86 -179.77 0.3 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.448 -162.592 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.4 m95 -145.91 -172.14 3.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.066 -1.425 . . . . 0.0 109.446 179.773 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.525 ' NE2' HG21 ' A' ' 10' ' ' VAL . 47.9 m80 -103.16 148.86 25.24 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.544 169.39 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 30.4 ttt180 -65.56 -50.36 56.96 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.79 -174.225 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.2 Cg_endo -57.31 -22.81 51.27 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 122.531 2.154 . . . . 0.0 113.542 174.152 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -84.16 -57.91 2.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.299 -170.757 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.463 ' HB2' HG23 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -60.79 93.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.456 -166.461 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.5 mtpm? -148.89 150.8 33.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 -174.912 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -66.54 136.08 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.198 161.896 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -115.22 33.41 5.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.044 167.559 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.16 -46.82 3.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.679 167.676 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.3 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.85 179.982 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.52 51.61 3.82 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.456 -1.057 . . . . 0.0 110.456 169.063 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -128.39 128.38 44.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.109 -0.546 . . . . 0.0 110.405 -176.268 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.469 ' HA ' ' CG ' ' A' ' 29' ' ' LYS . 55.8 m -60.98 139.22 58.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.298 168.563 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 13.5 mt -104.8 166.72 10.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.394 -166.359 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.2 -172.01 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.37 -167.935 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -61.02 -18.35 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.368 -168.141 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.61 0.02 OUTLIER Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 169.05 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.37 10.58 9.9 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 165.938 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 7.3 p80 -94.57 -169.91 2.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.422 177.614 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.61 -164.25 1.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.167 168.634 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.536 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -160.18 148.34 16.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.231 174.329 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -128.0 70.32 1.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.884 -166.642 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 58.36 89.64 0.05 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.898 -178.473 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.75 -28.86 12.54 Favored Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 164.847 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -141.98 137.42 15.94 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 121.439 0.637 . . . . 0.0 109.779 -173.553 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.536 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.9 Cg_endo -63.57 150.83 87.53 Favored 'Trans proline' 0 N--CA 1.486 1.05 0 C-N-CA 122.649 2.233 . . . . 0.0 113.505 169.067 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 86.1 m-85 -141.05 -164.9 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.949 162.799 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 13.5 m -57.43 -177.52 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.641 167.602 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -100.38 -26.12 13.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.844 158.351 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 50.6 m-70 -170.82 166.22 4.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 CA-C-N 114.645 -1.162 . . . . 0.0 109.343 172.178 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.503 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 Cg_endo -71.08 -7.84 12.62 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.656 -1.81 . . . . 0.0 113.604 -12.279 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.526 ' HA ' ' HB1' ' A' ' 58' ' ' ALA . 62.8 m -60.06 -32.42 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.534 -160.87 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -77.19 -36.08 55.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.334 -172.538 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 19.6 m -93.55 24.04 4.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.467 169.813 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.526 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . -81.7 -54.09 5.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.345 179.677 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.448 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 7.2 ttm -108.32 -17.99 13.87 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.71 -173.798 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CE1' ' HB3' ' A' ' 59' ' ' MET . 2.0 m-85 -132.23 -169.69 2.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.006 -164.256 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.484 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . 72.69 51.68 11.21 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -175.069 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 8.1 Cg_endo -61.08 71.39 0.08 OUTLIER 'Trans proline' 0 N--CA 1.486 1.069 0 C-N-CA 122.571 2.18 . . . . 0.0 113.508 168.014 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -88.39 -19.05 27.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.402 -167.535 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.29 63.19 4.18 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 -169.391 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.8 p90 173.52 168.46 0.17 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.272 168.96 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -151.11 -56.33 0.01 OUTLIER Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -170.54 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -113.2 87.63 2.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.437 -0.382 . . . . 0.0 110.378 -170.577 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -166.96 124.84 1.26 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.124 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.37 76.06 0.19 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -96.5 -39.66 9.45 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.117 -0.542 . . . . 0.0 110.239 -176.129 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -63.29 124.94 22.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.05 -168.9 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.14 132.15 20.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.424 169.404 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -86.92 140.65 29.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.365 -169.857 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.9 t -71.41 -55.27 8.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.468 169.938 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 76' ' ' LYS . 22.7 p90 -165.09 -37.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.4 169.65 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.487 ' N ' ' CD1' ' A' ' 75' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.456 170.051 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 N-CA-C 113.513 0.543 . . . . 0.0 113.513 . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -174.84 143.48 0.74 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.271 -168.541 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.1 t -80.79 131.08 61.5 Favored Pre-proline 0 C--O 1.245 0.85 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.399 -162.361 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.516 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 5.3 Cg_exo -68.56 -15.85 41.95 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 123.277 2.651 . . . . 0.0 113.372 168.39 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.37 -71.41 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.384 -167.743 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.6 p -91.53 -23.02 20.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.474 -162.249 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 t0 73.71 57.34 0.1 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.535 -166.444 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 174.68 8.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.971 158.556 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -93.14 150.5 20.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.701 168.205 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG23 ' CD2' ' A' ' 24' ' ' HIS . 55.6 t -111.4 113.63 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.829 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 12' ' ' PHE . 60.7 t80 -66.11 170.06 6.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.421 177.278 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.493 ' N ' ' CD2' ' A' ' 11' ' ' TYR . 38.3 m-85 -61.89 -82.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.515 -169.347 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.74 -10.96 60.37 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.758 -162.598 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -103.8 44.49 1.02 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.06 168.848 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -109.7 151.49 26.84 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.444 171.117 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.5 m -136.66 147.54 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.863 160.165 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 m -116.22 135.31 54.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.443 -166.783 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 t -178.17 123.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -171.156 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.468 ' HG ' ' CG ' ' A' ' 44' ' ' GLU . 1.9 mm? 60.26 32.42 20.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.423 -171.029 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.28 18.72 65.52 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 162.883 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.55 128.26 19.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 166.377 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.77 177.75 2.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.367 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.516 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 30.7 m95 -146.49 178.22 8.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.614 -176.253 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.518 ' CD2' HG23 ' A' ' 10' ' ' VAL . 45.7 m80 -98.79 140.22 33.3 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 114.075 -1.421 . . . . 0.0 110.494 169.035 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.541 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.38 -46.67 94.87 Favored Pre-proline 0 CA--C 1.544 0.73 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.848 -172.103 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.541 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 11.8 Cg_exo -48.78 -37.26 35.27 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.713 2.275 . . . . 0.0 113.486 167.781 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.45 -58.79 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.359 -165.389 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.515 HD12 ' CE1' ' A' ' 42' ' ' HIS . 2.0 tp -60.54 89.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.368 -164.575 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.515 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 mtmt -128.99 177.03 7.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.112 168.482 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.9 t -59.82 166.6 2.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.401 169.057 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -131.33 25.51 4.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.766 162.006 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.467 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tppm? -114.19 -63.59 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.324 169.147 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -92.05 -42.02 10.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.493 -165.333 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.2 62.5 0.81 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 -171.128 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -132.87 144.9 50.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.469 173.972 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.443 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -70.97 143.68 50.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.497 170.053 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.515 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 88.0 mt -109.08 -168.22 1.31 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.437 -169.412 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.8 170.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.249 -167.385 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.01 18.5 11.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.423 -175.716 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.62 50.61 0.06 OUTLIER Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 162.8 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 58.34 54.1 40.41 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 156.515 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.515 ' CE1' HD12 ' A' ' 28' ' ' LEU . 15.7 p80 -60.43 -170.7 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.029 -0.585 . . . . 0.0 110.586 178.25 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' A' ' 56' ' ' TYR . . . -135.63 175.69 9.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.404 -177.672 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -160.49 141.49 11.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.068 166.117 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.495 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 2.8 m80 -88.79 -42.16 12.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.388 -166.695 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.49 47.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.043 -171.31 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 21.59 53.59 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 -177.473 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -141.18 96.04 7.28 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.852 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.469 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 12.2 Cg_endo -62.97 144.49 93.19 Favored 'Trans proline' 0 N--CA 1.485 0.99 0 C-N-CA 122.714 2.276 . . . . 0.0 113.66 -170.217 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.3 m-85 -126.62 -174.12 3.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 169.969 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 64.3 m -59.2 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.123 -1.398 . . . . 0.0 110.511 169.297 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -110.47 -32.68 6.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.74 158.404 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 11.5 m-70 -145.23 175.01 2.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.365 162.647 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.53 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.7 Cg_endo -59.76 -15.66 2.49 Favored 'Cis proline' 0 N--CA 1.5 1.868 0 C-N-CA 120.651 -2.645 . . . . 0.0 112.331 -25.354 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.8 m -59.14 -50.61 73.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.798 -160.278 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.488 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 11.0 t80 -69.14 -41.21 77.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.462 -172.139 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.9 t -68.9 -21.35 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.415 179.785 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.48 98.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.29 -171.684 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.6 mmt -86.75 -42.58 13.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.418 169.433 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -95.26 101.92 13.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.36 -168.587 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.96 -104.97 0.19 Allowed Glycine 0 CA--C 1.543 1.828 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 170.471 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -56.05 -155.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.486 1.069 0 C-N-CA 122.473 2.115 . . . . 0.0 113.431 171.322 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.31 86.98 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 168.823 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.24 -142.52 3.54 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 -170.078 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 65.46 -77.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.366 -169.721 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.57 -144.89 14.91 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 169.493 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -177.83 139.6 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.353 -0.423 . . . . 0.0 110.367 169.917 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.0 39.35 2.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 -178.966 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -130.95 70.52 0.52 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 -170.082 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.44 118.45 20.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.212 -170.34 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 59.07 -79.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.623 175.667 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.5 t -135.95 -84.38 0.38 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.476 -178.21 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 61.54 175.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.399 169.808 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.7 t -79.32 -22.94 43.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.369 -170.307 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -68.17 144.95 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.377 -169.993 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.583 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.092 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -61.01 146.93 45.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.344 -167.402 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 22.9 t -79.93 129.36 70.77 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.383 -163.86 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.515 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.3 Cg_endo -67.88 -18.65 46.93 Favored 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 123.25 2.634 . . . . 0.0 113.497 169.088 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -68.61 0.78 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.251 -166.335 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -94.77 -24.42 17.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.479 -163.358 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t70 73.65 65.88 0.09 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.47 -165.767 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -129.04 -168.47 1.93 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.927 159.573 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -107.49 147.08 30.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.207 163.52 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG23 ' CD2' ' A' ' 24' ' ' HIS . 50.3 t -105.59 116.47 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.767 -163.741 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -166.85 0.65 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.289 -178.889 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.91 -83.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.48 -167.67 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.83 -12.47 61.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.726 -159.081 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -94.44 17.13 13.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.199 179.894 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.1 ptt-85 -88.53 149.24 23.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.329 -168.249 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 23' ' ' TRP . 17.9 m -148.25 119.54 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.067 161.66 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 42.9 m -93.03 137.16 32.63 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.397 -174.792 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 2.0 t -174.33 129.68 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.276 -168.815 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.473 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 1.8 mm? 59.98 31.85 20.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.571 -171.781 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.6 61.91 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 166.272 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -147.29 122.57 10.26 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 164.553 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -63.25 -179.82 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.381 -162.011 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.515 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.6 m95 -145.78 178.25 8.3 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.742 -178.015 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.523 ' CE1' ' HB2' ' A' ' 3' ' ' CYS . 48.2 m80 -98.24 146.53 25.54 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.202 -1.363 . . . . 0.0 110.51 171.055 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 tpt180 -62.04 -47.36 90.96 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.719 -171.949 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -62.85 -28.34 75.62 Favored 'Trans proline' 0 N--CA 1.484 0.961 0 C-N-CA 122.491 2.127 . . . . 0.0 113.531 176.915 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.23 -49.43 19.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.136 -165.743 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 37' ' ' LEU . 0.7 OUTLIER -73.03 94.55 1.9 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.341 -160.449 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.34 170.04 15.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.075 163.719 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -60.06 -174.89 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.318 172.144 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -144.65 22.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.65 157.327 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.02 -33.04 1.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.553 -165.106 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.5 p -110.7 -53.01 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.504 163.999 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.24 68.23 0.61 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -169.114 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -144.18 162.69 35.68 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.449 -178.778 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.07 156.49 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.424 169.88 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HB2' HD22 ' A' ' 28' ' ' LEU . 5.8 mt -129.53 173.84 10.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.261 -166.851 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.21 -162.43 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.351 -160.394 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -61.08 -85.44 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.424 -177.863 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.33 48.36 1.03 Allowed Glycine 0 CA--C 1.539 1.543 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 159.498 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.82 -105.85 0.01 OUTLIER Glycine 0 CA--C 1.533 1.162 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 152.443 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.519 ' NE2' HD22 ' A' ' 28' ' ' LEU . 4.3 p80 -58.74 -170.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.862 -0.669 . . . . 0.0 110.806 -163.675 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -125.55 -166.9 1.61 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.96 160.965 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.473 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -135.73 146.44 47.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.071 -176.31 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.5 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.6 t60 -147.48 112.1 5.32 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.759 178.589 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.65 43.1 19.42 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.603 167.739 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.92 46.13 18.24 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 165.629 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 pttt 176.26 97.3 0.1 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -178.184 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.8 144.08 96.62 Favored 'Trans proline' 0 N--CA 1.484 0.955 0 C-N-CA 122.936 2.424 . . . . 0.0 113.555 -167.562 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.9 OUTLIER -131.55 171.18 13.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.728 161.973 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 55.8 m -58.62 145.45 39.6 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 113.836 -1.529 . . . . 0.0 110.81 174.646 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.25 -34.92 75.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.383 -1.28 . . . . 0.0 110.369 175.291 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.1 m-70 -163.07 165.22 15.04 Favored Pre-proline 0 CA--C 1.549 0.909 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.529 166.729 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -69.89 -6.08 9.43 Favored 'Cis proline' 0 N--CA 1.483 0.881 0 C-N-CA 122.594 -1.836 . . . . 0.0 113.689 -11.523 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 93.2 m -60.37 -50.37 73.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.577 -161.693 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -62.03 -37.86 86.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.351 -172.307 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.438 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -107.24 29.28 7.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.474 175.751 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 55' ' ' CYS . . . -84.21 -68.79 0.69 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.365 171.212 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.0 ttt -86.87 -37.55 17.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.397 -168.569 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.5 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 28.6 m-85 -67.64 83.74 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.445 -169.264 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -140.57 -165.79 10.43 Favored Glycine 0 CA--C 1.544 1.885 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -173.818 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -56.4 -57.58 1.37 Allowed 'Trans proline' 0 N--CA 1.484 0.935 0 C-N-CA 122.461 2.107 . . . . 0.0 113.597 -173.964 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.1 mtmp? -66.32 134.18 52.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.407 -169.968 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.7 -151.46 8.81 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 170.609 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' CD2' ' N ' ' A' ' 66' ' ' GLY . 52.8 p90 -96.61 -50.66 4.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.455 . . . . 0.0 110.334 170.117 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 65' ' ' PHE . . . -147.33 -86.49 0.06 OUTLIER Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 170.284 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 65.25 167.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.333 -0.433 . . . . 0.0 110.295 170.271 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.34 133.08 0.06 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 170.613 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -138.25 25.13 2.91 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 170.459 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.27 -82.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.121 -0.539 . . . . 0.0 110.39 172.128 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -169.64 -177.89 2.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.978 -168.667 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 t -107.43 -80.21 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.341 169.329 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.6 p80 175.12 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.403 170.074 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.89 -74.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.484 170.1 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.14 158.33 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.383 -177.24 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.392 -170.049 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.484 0.955 0 N-CA-C 113.494 0.536 . . . . 0.0 113.494 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.527 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 15.3 tttt 65.2 153.58 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.47 165.903 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 15.1 t -72.41 128.61 88.47 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.584 -166.663 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.52 ' HG2' ' CZ3' ' A' ' 23' ' ' TRP . 3.7 Cg_exo -69.99 -7.86 22.17 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.363 2.708 . . . . 0.0 113.39 168.946 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -70.86 0.71 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.276 -173.648 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -97.03 -21.73 17.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.656 -161.152 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t0 73.75 62.98 0.09 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.529 -167.897 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -140.06 166.71 23.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.895 158.947 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.527 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -85.23 152.39 23.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.836 179.609 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG21 ' NE2' ' A' ' 24' ' ' HIS . 98.8 t -124.65 125.36 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.334 -164.013 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 12' ' ' PHE . 9.7 t80 -172.23 136.79 0.85 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -159.64 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 11' ' ' TYR . 2.2 m-85 70.64 178.12 0.26 Allowed 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -162.677 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.27 -0.5 10.11 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.584 -155.443 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.31 -18.92 52.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.41 171.081 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.516 ' HB3' HG11 ' A' ' 10' ' ' VAL . 9.8 ptm180 -87.03 127.64 35.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.307 -168.432 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.3 m -127.85 171.33 16.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.091 166.18 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -127.31 137.62 52.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.452 -167.585 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.472 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 10.1 t -176.05 126.65 0.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.315 -175.746 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 19' ' ' LEU . 2.0 mm? 60.22 24.59 13.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.473 -171.622 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.37 -24.76 25.89 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 162.908 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.477 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.5 mptp? -113.45 132.17 55.75 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.23 -178.263 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -70.47 179.35 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.32 -163.246 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.52 ' CZ3' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.63 164.8 34.17 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.732 -176.923 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.517 ' NE2' HG21 ' A' ' 10' ' ' VAL . 35.9 m80 -85.35 137.06 33.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.481 164.412 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 3.9 tpm_? -61.21 -49.45 88.16 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.817 -172.651 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.9 Cg_endo -58.58 -16.7 31.3 Favored 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 122.568 2.179 . . . . 0.0 113.569 174.234 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.88 -49.41 7.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.298 -177.223 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.514 HD23 ' NE2' ' A' ' 42' ' ' HIS . 1.7 tp -62.92 86.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.378 -167.226 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 11.9 mtmt -133.86 163.8 28.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.359 -178.159 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -64.53 157.78 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 168.157 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -126.31 24.91 6.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.997 164.366 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.47 ' HD3' ' HB3' ' A' ' 55' ' ' CYS . 3.6 tttp -109.29 -64.15 1.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.198 163.01 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -92.8 -19.08 22.1 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.517 -165.084 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.91 53.4 3.53 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 167.554 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -143.93 147.52 34.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.058 -0.571 . . . . 0.0 110.433 179.796 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.49 171.64 1.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.508 176.54 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.526 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 5.3 mt -133.14 176.58 8.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.285 -177.498 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.03 -174.68 2.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.376 -165.804 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.11 -15.5 33.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.437 -170.02 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.56 67.16 0.03 OUTLIER Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 167.519 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -122.62 11.77 8.92 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 165.775 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.514 ' NE2' HD23 ' A' ' 28' ' ' LEU . 4.6 p80 -97.2 -169.19 1.82 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.876 -0.662 . . . . 0.0 110.369 174.754 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.98 -165.64 2.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.246 166.32 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 20.3 tt0 -158.32 151.16 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.997 -174.821 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.518 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 8.4 p80 -93.19 16.26 13.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.562 171.216 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 58.7 72.95 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.675 -169.585 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 167.64 -41.98 0.24 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -179.634 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.85 134.3 4.31 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-O 121.494 0.664 . . . . 0.0 109.652 169.65 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.499 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 18.9 Cg_endo -60.62 145.46 98.8 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 C-N-CA 122.42 2.08 . . . . 0.0 113.625 -178.413 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 3.0 m-85 -133.53 -164.81 1.54 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.76 162.268 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 60.1 m -59.09 -171.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.418 167.794 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -99.86 -31.85 11.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.12 163.186 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 49.6 m-70 -168.23 165.3 7.84 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.542 171.652 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.3 Cg_endo -70.44 -5.58 10.01 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.637 -1.818 . . . . 0.0 113.672 -10.789 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 65.0 m -60.07 -39.75 87.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.494 -161.412 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -67.95 -36.75 80.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.426 -170.957 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.9 p -100.25 21.04 13.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.434 174.768 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.459 ' CB ' ' HE2' ' A' ' 32' ' ' LYS . . . -60.86 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.425 172.12 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.1 ttp -129.41 -25.63 2.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.438 -169.202 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.518 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 23.7 m-85 -74.58 102.6 4.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.359 -168.162 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.16 31.32 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -172.54 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -57.96 129.15 31.84 Favored 'Trans proline' 0 N--CA 1.485 0.982 0 C-N-CA 122.57 2.18 . . . . 0.0 113.519 -173.488 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? 178.6 -72.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.321 169.472 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.18 -171.81 39.01 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 170.357 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -151.65 122.33 7.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.278 -0.461 . . . . 0.0 110.382 170.05 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -153.09 -113.31 0.53 Allowed Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 170.179 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.08 125.88 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.369 170.119 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.22 -139.86 14.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -170.187 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -124.03 -129.53 3.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 170.261 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -173.12 -163.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.409 -0.396 . . . . 0.0 110.281 -169.939 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 58.48 29.87 18.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.603 -168.767 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.64 101.96 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.374 169.375 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -100.45 -70.01 0.75 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.402 169.986 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -146.93 -61.47 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.363 -177.87 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 65.62 146.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.318 -169.891 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.239 0.518 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.347 -170.222 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.486 1.061 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 9' ' ' GLU . 16.5 mtpt 61.94 167.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.379 168.837 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.5 t -80.28 127.36 76.61 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.457 -164.224 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -67.07 -13.86 41.34 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 123.228 2.619 . . . . 0.0 113.465 167.447 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.45 -73.11 0.59 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.41 -172.245 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -91.44 -13.42 32.33 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.479 -168.202 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.11 56.96 3.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.655 -167.99 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 2.5 tttt -110.17 -167.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.965 158.925 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.533 ' HA ' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -107.86 149.57 28.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.263 162.863 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.515 HG21 ' NE2' ' A' ' 24' ' ' HIS . 66.1 t -111.13 113.84 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.921 -166.9 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.07 -168.61 1.32 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.365 175.78 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -72.43 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.451 -165.446 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.77 -1.14 8.41 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.036 -0.666 . . . . 0.0 111.62 -161.076 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.4 17.53 23.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.386 178.348 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 151.97 19.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.311 -165.079 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.462 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 18.2 m -147.98 145.37 18.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.916 160.151 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 28.2 m -118.9 134.83 54.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -167.56 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 20.7 t -178.18 131.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.316 -169.87 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 44' ' ' GLU . 2.1 mm? 60.19 20.65 10.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.454 -169.435 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.68 -24.39 28.2 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 165.438 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.39 141.66 45.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.843 -0.678 . . . . 0.0 110.224 -177.593 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.4 177.01 9.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.394 -164.562 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.521 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.6 m95 -146.95 179.67 7.44 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.665 -176.181 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.515 ' NE2' HG21 ' A' ' 10' ' ' VAL . 38.4 m80 -100.07 136.56 39.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.468 165.424 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.525 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.77 -47.09 44.8 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.85 -172.121 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -47.72 -38.71 29.89 Favored 'Trans proline' 0 N--CA 1.485 1.006 0 C-N-CA 122.711 2.274 . . . . 0.0 113.46 166.525 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -68.05 -56.41 8.99 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.255 -178.393 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.51 HD22 ' CD2' ' A' ' 42' ' ' HIS . 5.7 tp -60.46 89.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.37 -163.768 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.0 pttt -132.4 160.01 37.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.36 171.773 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.2 t -60.74 158.69 12.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.276 167.239 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 23.5 pt-20 -134.44 23.55 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.577 159.043 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.401 ' CD ' ' HE1' ' A' ' 59' ' ' MET . 0.0 OUTLIER -110.84 -36.62 5.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.505 -179.764 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.6 -52.62 2.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.463 164.838 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 114.56 57.86 0.37 Allowed Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 172.027 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -136.82 143.1 42.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.412 168.836 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.498 ' HA ' ' HB3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -61.77 157.59 17.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.475 175.206 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 6.6 mt -116.19 -173.09 2.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.342 -171.013 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.31 -176.72 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.341 -167.363 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.2 p -61.58 -21.39 64.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.387 -168.513 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.04 53.63 0.06 OUTLIER Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.728 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.49 10.58 14.44 Favored Glycine 0 CA--C 1.522 0.475 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 167.099 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 6.7 p80 -86.57 -170.0 2.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.231 -0.485 . . . . 0.0 110.386 174.629 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB1' ' HA ' ' A' ' 52' ' ' ASN . . . -154.45 -168.97 3.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.142 166.687 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -170.7 152.88 3.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.947 -168.45 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.438 ' CB ' ' CE2' ' A' ' 60' ' ' PHE . 85.5 t60 -130.87 73.52 1.55 Allowed 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.97 179.731 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.48 83.63 0.12 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.916 -176.465 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.36 45.93 66.52 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 167.397 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.34 90.11 0.51 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.538 0.685 . . . . 0.0 109.845 169.838 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.89 145.25 99.32 Favored 'Trans proline' 0 N--CA 1.485 1.023 0 C-N-CA 122.514 2.143 . . . . 0.0 113.691 -178.318 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 54.1 m-85 -144.48 -159.8 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.906 167.888 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 36.4 m -55.39 179.61 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.26 170.886 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.435 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 32.5 t-20 -105.15 -29.42 10.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.605 157.66 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.525 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.38 166.14 16.84 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.276 164.923 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.525 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -69.83 -14.69 12.63 Favored 'Cis proline' 0 N--CA 1.482 0.81 0 C-N-CA 122.41 -1.912 . . . . 0.0 113.654 -13.629 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.7 m -59.85 -49.56 77.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.511 -160.032 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.84 -48.73 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.265 -170.812 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 6.8 m -72.89 -18.74 61.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.383 -174.471 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.98 -59.65 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.264 -170.289 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.401 ' HE1' ' CD ' ' A' ' 32' ' ' LYS . 9.9 mmt -65.83 -37.11 85.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.398 -169.924 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.438 ' CE2' ' CB ' ' A' ' 45' ' ' HIS . 28.8 m-85 -93.33 85.24 4.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.377 176.47 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.25 -172.52 23.24 Favored Glycine 0 CA--C 1.544 1.904 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -172.766 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.528 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 6.9 Cg_endo -58.07 -79.66 0.02 OUTLIER 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.503 2.135 . . . . 0.0 113.548 -173.567 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 2.1 mppt? -138.52 -77.02 0.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.294 -0.867 . . . . 0.0 110.343 -169.508 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.31 -34.34 2.62 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -170.001 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -168.83 -64.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.409 -0.395 . . . . 0.0 110.345 169.925 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 145.1 84.76 0.06 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 170.177 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 mtt-85 61.02 24.88 14.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.431 -0.384 . . . . 0.0 110.424 170.154 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -39.35 2.84 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -178.718 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.46 -77.69 0.23 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.601 -0.999 . . . . 0.0 110.601 -170.12 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.07 -171.72 2.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.274 175.578 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -50.09 67.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.963 -168.897 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -148.93 111.91 4.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.376 169.336 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -67.43 111.51 4.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.342 -169.935 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.5 t -167.74 -61.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.425 170.041 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.79 -57.27 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.374 176.817 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HD3' ' HA ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.559 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.276 170.021 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.537 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 21.7 Cg_exo . . . . . 0 N--CA 1.485 0.982 0 N-CA-C 113.569 0.565 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER 66.12 125.84 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.672 165.605 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.508 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 21.7 t -93.96 120.83 65.36 Favored Pre-proline 0 C--O 1.245 0.829 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.575 -168.44 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.3 Cg_exo -75.97 -5.66 16.58 Favored 'Trans proline' 0 N--CA 1.483 0.856 0 C-N-CA 123.201 2.601 . . . . 0.0 113.818 173.628 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.526 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.94 -78.65 0.38 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.573 -179.719 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -77.04 -23.21 52.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.501 -173.016 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 71.89 47.7 0.31 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.475 -173.762 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.7 -168.91 1.61 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.829 159.277 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -108.67 154.65 21.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.708 160.975 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.52 HG21 ' NE2' ' A' ' 24' ' ' HIS . 54.1 t -114.94 115.36 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.403 -162.894 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -92.17 55.09 2.5 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.852 -156.942 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 67.54 -79.99 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.594 173.668 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.07 0.11 25.91 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.383 -162.48 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -107.0 12.69 28.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.254 175.954 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.05 26.06 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.271 -163.083 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' A' ' 25' ' ' ARG . 15.8 m -148.27 121.89 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.843 158.265 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 90.1 m -97.48 136.72 37.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.414 -161.659 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 23.0 t -178.2 137.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.428 -167.799 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.431 ' CG ' ' HG2' ' A' ' 44' ' ' GLU . 2.7 mm? 60.04 22.11 11.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.625 -171.248 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.05 -23.14 22.31 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 168.797 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -122.31 126.73 48.72 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.739 -0.731 . . . . 0.0 110.021 -176.634 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.537 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -60.43 -175.47 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.365 -160.995 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.526 ' CZ3' ' HB2' ' A' ' 5' ' ' LYS . 72.5 m95 -146.49 -172.79 4.03 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 112.892 -1.958 . . . . 0.0 109.501 179.127 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.52 ' NE2' HG21 ' A' ' 10' ' ' VAL . 47.0 m80 -100.75 153.01 19.81 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.612 165.211 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.454 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -69.22 -63.85 1.89 Allowed Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.788 179.943 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -50.84 -17.56 3.37 Favored 'Trans proline' 0 N--CA 1.485 1.013 0 C-N-CA 122.301 2.001 . . . . 0.0 113.455 177.337 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.472 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -80.99 -52.89 6.94 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.394 178.692 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.508 HD12 ' CE1' ' A' ' 42' ' ' HIS . 2.9 tp -72.98 82.84 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.319 -163.952 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -138.45 172.07 13.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.304 167.931 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -67.97 157.68 34.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.357 174.297 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.36 23.67 5.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.749 161.399 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.461 ' NZ ' ' CE2' ' A' ' 60' ' ' PHE . 0.9 OUTLIER -116.95 -41.36 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.471 -171.45 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -110.98 -52.44 2.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.782 173.264 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.05 59.01 0.25 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 173.076 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.0 mtpp -149.07 168.28 23.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.408 -177.568 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.0 m -92.87 168.05 11.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.381 -178.78 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 42' ' ' HIS . 4.1 mt -131.65 131.45 43.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.419 -167.563 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.91 -170.15 3.31 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.232 173.014 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.42 14.74 8.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.026 -163.45 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.31 45.89 95.3 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 -162.734 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -94.13 9.9 72.13 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 -163.385 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.508 ' CE1' HD12 ' A' ' 28' ' ' LEU . 3.5 p80 -106.32 -171.6 1.93 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.142 0.496 . . . . 0.0 110.545 -173.656 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -176.37 159.63 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.134 175.74 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HG2' ' CG ' ' A' ' 19' ' ' LEU . 1.1 pt-20 -109.47 140.7 42.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.961 -165.134 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.491 ' CE1' ' CD1' ' A' ' 60' ' ' PHE . 43.3 t60 -94.41 41.22 1.09 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.797 1.284 . . . . 0.0 109.506 161.89 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.5 98.78 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.622 -171.833 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.22 37.22 43.03 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 168.4 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mttt 179.95 96.31 0.19 Allowed Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.238 0.542 . . . . 0.0 109.724 172.892 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -63.52 146.5 92.94 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 C-N-CA 122.754 2.302 . . . . 0.0 113.546 -173.521 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -145.13 -162.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.938 166.411 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.7 m -57.52 179.45 0.06 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.724 167.925 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.54 -27.56 12.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.066 161.426 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 44.8 m-70 -164.83 166.99 10.47 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.464 170.178 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.531 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.5 Cg_endo -68.69 -7.94 8.47 Favored 'Cis proline' 0 N--CA 1.482 0.834 0 C-N-CA 122.513 -1.87 . . . . 0.0 113.702 -12.693 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.1 m -60.48 -52.71 64.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.417 -162.461 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -60.72 -33.37 72.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.394 -168.366 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.515 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.9 OUTLIER -112.08 26.78 10.26 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.322 179.97 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.79 -66.73 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.323 178.783 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 32.7 mtt -107.87 -27.89 9.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.396 -167.548 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.491 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -75.06 90.37 2.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.321 -170.154 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 177.62 72.72 0.06 OUTLIER Glycine 0 CA--C 1.544 1.88 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 -172.559 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -56.98 -53.89 4.4 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.518 2.145 . . . . 0.0 113.545 -172.223 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.41 -77.48 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.361 -169.004 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.27 156.64 26.81 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 170.094 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -126.39 -177.48 4.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.344 170.059 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -141.21 111.56 0.72 Allowed Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -170.09 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.75 32.88 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.338 -0.431 . . . . 0.0 110.371 169.959 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 150.99 44.27 0.02 OUTLIER Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -178.869 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -119.28 83.63 0.36 Allowed Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 170.286 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -147.64 21.48 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.359 169.857 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.8 -53.3 57.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.992 -168.78 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -155.08 -41.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.382 174.329 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 58.0 m80 66.09 25.44 10.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.391 -169.696 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.6 p -60.82 -86.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.42 170.261 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -105.73 -75.99 0.62 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.294 -0.867 . . . . 0.0 110.348 -169.858 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.58 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.38 178.407 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 160.89 30.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.406 -168.57 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.2 t -81.15 130.82 61.29 Favored Pre-proline 0 C--O 1.246 0.872 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.461 -162.689 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.518 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -69.08 -18.13 40.33 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 123.379 2.719 . . . . 0.0 113.368 166.908 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 -70.9 0.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.381 -167.301 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.1 p -91.65 -24.17 19.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.432 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 73.03 54.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.505 -167.609 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.432 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 4.2 tptp -112.64 -169.27 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.822 158.409 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -109.52 150.97 27.37 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.526 161.386 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG23 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -107.74 114.9 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.63 -165.439 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -101.36 56.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.023 0.915 . . . . 0.0 110.079 -158.906 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.27 -80.59 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.354 170.8 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.02 -6.37 56.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.414 -157.615 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -114.09 41.66 2.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.082 163.502 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -86.45 149.16 25.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.367 177.758 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -147.12 122.4 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.623 158.392 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.6 m -100.02 136.89 39.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.399 -162.252 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.504 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.7 t -177.67 127.18 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.307 -166.361 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.463 ' HG ' ' HG2' ' A' ' 44' ' ' GLU . 2.6 mm? 60.12 29.79 19.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.699 -171.758 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.51 17.19 47.17 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 167.57 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.24 119.33 12.75 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 164.903 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -62.03 -178.21 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.396 -159.291 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.518 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 51.2 m95 -146.47 -174.41 4.45 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 113.838 -1.528 . . . . 0.0 109.473 179.42 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 10' ' ' VAL . 46.3 m80 -100.57 154.61 18.43 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.59 172.021 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.84 -56.75 29.26 Favored Pre-proline 0 C--O 1.241 0.634 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.851 -173.851 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.8 Cg_exo -64.01 -27.87 66.09 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 122.695 2.263 . . . . 0.0 113.545 -179.178 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -69.95 -53.49 17.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.218 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.514 HD13 ' CE1' ' A' ' 42' ' ' HIS . 2.2 tp -60.04 100.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.434 -159.082 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -132.64 147.28 52.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.217 -170.037 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -59.79 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.337 168.554 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.513 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.9 tt0 -146.47 25.41 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.753 157.722 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.11 -38.34 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.522 -169.045 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -104.88 -31.59 9.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.32 165.19 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 56.15 1.9 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 160.439 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.61 175.36 3.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.369 161.416 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.39 179.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.44 -162.095 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.497 HD11 ' CG ' ' A' ' 42' ' ' HIS . 6.8 mt -131.73 -172.18 2.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.3 -173.973 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 92.1 m -123.95 137.82 54.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 -176.025 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 t 59.69 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.558 165.372 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.58 44.1 0.18 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 160.224 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.08 11.08 56.35 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.878 -0.661 . . . . 0.0 111.553 -175.705 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.514 ' CE1' HD13 ' A' ' 28' ' ' LEU . 8.1 p80 -90.56 -169.49 2.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.897 -0.651 . . . . 0.0 110.39 172.041 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -154.27 154.45 33.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.14 166.837 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -100.3 146.92 26.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.155 -178.742 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 86.1 t60 -87.7 -45.88 9.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.813 166.1 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.82 79.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.009 166.264 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.78 -23.29 33.45 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 175.077 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 97.79 25.38 Favored Pre-proline 0 C--O 1.244 0.776 0 CA-C-N 115.003 -0.599 . . . . 0.0 109.697 -173.976 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -65.77 142.05 68.26 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.629 2.219 . . . . 0.0 113.711 -170.161 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.9 m-85 -135.41 167.29 21.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.399 163.486 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 42.9 m -59.53 153.7 19.04 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 113.725 -1.58 . . . . 0.0 110.448 172.741 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -61.81 -45.91 91.79 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.321 179.001 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.5 m-70 -158.36 163.58 23.96 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.517 169.025 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.53 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -71.49 -3.8 10.76 Favored 'Cis proline' 0 N--CA 1.483 0.891 0 C-N-CA 122.748 -1.772 . . . . 0.0 113.817 -9.168 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 88.3 m -60.06 -59.16 5.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.407 -160.982 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -60.63 -40.74 93.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.454 -169.301 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.518 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 13.3 p -64.81 -21.29 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.422 176.835 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.28 -44.31 83.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.228 -169.149 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -91.57 -49.02 6.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.439 168.399 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 8.0 m-85 -119.8 81.94 1.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.277 -171.634 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 57' ' ' SER . . . -118.74 141.1 15.75 Favored Glycine 0 CA--C 1.543 1.822 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -170.261 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.97 -33.24 96.93 Favored 'Trans proline' 0 N--CA 1.482 0.85 0 C-N-CA 122.601 2.2 . . . . 0.0 113.652 172.488 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -82.02 -57.78 3.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.289 -169.136 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.87 95.39 0.09 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.959 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.7 p90 56.82 83.71 0.1 Allowed 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 122.188 -0.595 . . . . 0.0 111.844 177.251 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -143.83 73.11 0.35 Allowed Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 175.512 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -143.99 -73.35 0.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.427 170.012 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -154.68 -174.37 24.6 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.613 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.82 -58.84 0.03 OUTLIER Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -170.406 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.7 147.99 47.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.347 -0.427 . . . . 0.0 110.201 -169.954 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -164.33 122.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.113 169.009 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 m -78.52 -83.89 0.08 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.38 -169.385 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.21 145.92 52.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.393 -170.046 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.95 -55.53 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.427 170.133 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.84 -79.38 0.33 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.341 169.939 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.645 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.419 178.443 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.042 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -146.72 134.94 21.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.318 -169.399 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.4 t -84.38 114.94 57.96 Favored Pre-proline 0 C--O 1.25 1.123 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.158 -163.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -59.82 -20.54 59.73 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.787 2.325 . . . . 0.0 113.278 170.191 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -73.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.389 -175.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -93.55 -21.46 19.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.558 -165.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 72.61 57.22 0.13 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.47 -171.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.23 -168.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.99 159.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.46 152.24 22.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.572 162.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.9 t -112.09 112.35 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.627 -163.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 17.4 t80 -69.05 153.34 43.94 Favored 'General case' 0 N--CA 1.458 -0.038 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.285 176.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.495 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 2.7 m-85 -60.44 -62.05 2.15 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.835 -159.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.41 10.61 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.644 -173.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -102.55 13.95 33.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.449 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.0 154.72 17.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.228 -161.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.25 151.98 14.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.748 156.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.58 136.48 52.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.616 -169.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.9 t -174.83 131.83 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.185 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.593 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.1 mm? 60.04 34.52 21.39 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.558 -170.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.08 18.18 57.0 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 169.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -137.75 154.01 49.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 164.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.434 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.5 m-20 -88.14 176.9 7.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.367 -166.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -148.96 -177.25 5.7 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.251 -1.341 . . . . 0.0 109.074 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.7 m80 -99.54 143.22 30.03 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.475 169.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.71 -45.15 96.94 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.844 -167.209 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.3 Cg_endo -64.05 -36.46 48.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.589 2.192 . . . . 0.0 113.669 174.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.48 -46.71 84.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.233 -165.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.542 HD21 ' CE1' ' A' ' 42' ' ' HIS . 4.3 tp -62.77 83.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.367 -166.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -142.21 149.72 40.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.425 -166.336 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -65.5 127.59 32.46 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.472 175.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 1.2 tt0 -95.97 22.53 7.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.255 -1.338 . . . . 0.0 110.177 171.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 -58.98 2.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.318 169.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.2 p -104.81 -19.94 13.75 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.851 -170.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.89 37.19 34.14 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 176.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -96.1 128.12 42.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.496 -0.352 . . . . 0.0 110.335 167.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.2 m -61.14 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 42' ' ' HIS . 57.1 mt -98.08 167.22 11.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.378 -164.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 39' ' ' SER . 59.4 m -125.28 173.78 8.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.228 -164.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.574 ' N ' HG22 ' A' ' 38' ' ' THR . 1.0 OUTLIER -61.13 91.96 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.48 -178.51 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.53 57.1 8.54 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.22 12.78 3.55 Favored Glycine 0 CA--C 1.524 0.597 0 CA-C-N 114.757 -0.721 . . . . 0.0 111.701 166.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.658 ' HB2' HD13 ' A' ' 37' ' ' LEU . 43.1 p-80 -110.86 -168.96 1.37 Allowed 'General case' 0 C--O 1.231 0.084 0 CA-C-N 114.762 -0.719 . . . . 0.0 110.594 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.95 158.52 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.69 165.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -110.09 124.93 52.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.974 -160.302 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.499 ' HB3' ' HG3' ' A' ' 48' ' ' LYS . 57.6 t-80 -99.53 163.07 12.66 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.121 158.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.46 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 16.4 mp0 -60.31 92.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.241 -160.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.89 45.99 15.09 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.586 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HG3' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -177.97 104.81 0.21 Allowed Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 121.6 0.714 . . . . 0.0 109.956 169.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -61.77 172.57 3.63 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.603 2.202 . . . . 0.0 113.668 167.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 63.5 m-85 -169.11 177.55 4.8 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.01 -171.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 83.9 m -58.21 140.69 52.57 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.136 -1.393 . . . . 0.0 110.066 160.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.73 -38.94 86.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.191 164.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.467 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.7 m80 -153.21 173.45 4.59 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.342 165.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.8 Cg_endo -62.59 -18.71 4.6 Favored 'Cis proline' 0 N--CA 1.494 1.504 0 C-N-CA 121.248 -2.397 . . . . 0.0 112.537 -23.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.1 m -57.49 -41.69 81.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.146 -154.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -60.93 -48.02 83.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.412 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.403 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 24.8 t -72.03 -18.07 61.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.437 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.288 -171.053 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.427 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 14.4 Cg_exo . . . . . 0 N--CA 1.485 1.012 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.85 140.82 21.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.386 -167.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.7 t -86.96 116.47 66.17 Favored Pre-proline 0 C--O 1.25 1.108 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.104 -163.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.7 Cg_endo -59.51 -18.08 44.76 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 C-N-CA 122.784 2.322 . . . . 0.0 113.233 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -84.06 -69.44 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.466 -171.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.95 -21.92 18.3 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.638 -168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 t70 72.29 53.33 0.18 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.457 -171.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -111.7 -168.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.981 159.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.49 152.33 23.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.724 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.3 t -112.2 111.23 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.633 -163.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -73.65 157.63 36.24 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.287 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.17 -62.32 1.95 Allowed 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -158.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.62 -12.34 61.5 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.723 -173.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 1.6 mp0 -102.31 44.75 0.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.058 170.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -111.2 150.17 29.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.412 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.45 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -140.74 146.34 24.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.528 155.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -115.46 138.35 51.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.748 -166.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -178.19 132.09 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.22 -171.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.05 20.67 9.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.572 -171.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.85 -24.41 21.16 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 170.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -105.17 154.55 20.05 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 114.87 -0.665 . . . . 0.0 110.137 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -92.2 176.89 6.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.375 -165.258 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 24.1 m95 -150.49 -175.14 4.98 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.233 -1.348 . . . . 0.0 108.971 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.4 m80 -100.13 150.27 22.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 113.963 -1.471 . . . . 0.0 110.624 168.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 22.6 mtp180 -61.32 -56.56 32.76 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.922 -170.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 5.9 Cg_endo -58.77 -36.92 96.33 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.413 2.075 . . . . 0.0 113.567 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.81 -46.36 90.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.285 -164.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.681 HD21 ' CE1' ' A' ' 42' ' ' HIS . 7.8 tp -60.02 89.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.236 -160.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.1 tttp -138.4 146.57 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.307 -162.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -66.2 123.64 20.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.446 171.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB2' ' HE3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -96.72 36.95 1.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.954 168.615 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.84 -44.38 0.88 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.208 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.8 p -116.7 -21.62 8.99 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.006 176.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.94 44.51 11.94 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -105.39 131.06 53.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.422 170.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.2 m -61.0 147.35 43.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.368 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.588 HD13 ' CB ' ' A' ' 42' ' ' HIS . 60.7 mt -110.93 173.99 6.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.331 -168.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.592 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -122.01 -175.61 3.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.381 -167.054 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG22 ' A' ' 38' ' ' THR . 16.7 t -66.71 -18.94 65.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.376 -167.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.9 62.91 0.08 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 171.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -129.15 12.33 6.08 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.681 ' CE1' HD21 ' A' ' 28' ' ' LEU . 34.0 p-80 -103.87 -168.91 1.56 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.981 -0.609 . . . . 0.0 110.436 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.1 158.61 7.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.966 161.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.512 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 4.4 tt0 -115.19 121.31 42.57 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.015 -160.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.451 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -75.0 151.17 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.572 157.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.72 76.37 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.931 -176.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.39 -59.52 0.3 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -163.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.53 ' HE3' ' HB2' ' A' ' 31' ' ' GLU . 14.0 mtpp -155.32 140.19 12.05 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-O 121.339 0.59 . . . . 0.0 110.052 -160.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.653 ' HG3' HD12 ' A' ' 28' ' ' LEU . 12.2 Cg_endo -66.04 154.15 75.21 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.958 2.439 . . . . 0.0 113.568 165.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 28.7 m-85 -149.02 -167.24 2.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.84 166.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.6 m -57.7 134.24 56.04 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.287 166.075 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -68.22 -32.09 72.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.909 159.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.717 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 42.6 m80 -150.96 163.42 23.77 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.338 165.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -68.44 -22.53 8.56 Favored 'Cis proline' 0 N--CA 1.487 1.129 0 C-N-CA 122.427 -1.905 . . . . 0.0 112.798 -18.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 85.6 m -56.99 -43.02 81.32 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.214 -153.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -69.5 -37.8 77.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.471 170.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.717 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 48.1 t -60.77 -17.61 50.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.48 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.187 -167.967 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.466 0.525 . . . . 0.0 113.466 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -122.23 157.61 31.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.469 -175.006 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -84.92 119.92 73.14 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.246 -161.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -61.55 -25.02 78.93 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.778 2.319 . . . . 0.0 113.236 169.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -75.43 -74.36 0.21 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.421 -176.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -91.67 -22.41 20.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.608 -166.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 72.72 51.92 0.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.575 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.52 -169.01 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.841 158.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.3 155.0 19.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.449 160.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 47.9 t -112.29 112.13 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.666 -165.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.19 164.34 26.18 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.273 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.35 -62.4 1.9 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 -159.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -12.94 61.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.712 -173.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -101.22 44.55 1.01 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.093 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.54 144.57 40.55 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.483 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.12 119.65 5.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.606 154.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 95.9 m -99.97 141.49 32.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.365 -163.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.659 ' OG ' HD13 ' A' ' 19' ' ' LEU . 28.5 t -170.13 133.87 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.275 -163.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 ' OG ' ' A' ' 18' ' ' SER . 6.8 mp 59.87 18.34 7.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.471 161.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.66 -24.2 8.1 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 164.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -140.05 158.17 44.48 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.218 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.6 m-20 -84.31 178.33 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.301 -165.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 48.9 m95 -147.91 -174.69 4.63 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 113.689 -1.596 . . . . 0.0 109.486 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.6 m80 -99.92 157.81 16.26 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.198 -1.364 . . . . 0.0 110.659 170.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.573 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 ttp180 -66.83 -60.03 6.93 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.817 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -60.39 -20.43 63.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.394 2.063 . . . . 0.0 113.723 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.56 -54.64 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.19 -169.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 37' ' ' LEU . 1.3 tp -65.05 84.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.327 -163.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.58 148.62 52.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 -170.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.6 t -64.76 127.79 33.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.392 172.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -95.8 34.22 1.55 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.049 171.454 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -56.2 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.426 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.5 p -104.67 -17.93 14.48 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.085 -174.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.05 39.88 44.42 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 174.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -118.79 138.07 52.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.991 -0.605 . . . . 0.0 110.449 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -68.39 159.99 30.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.382 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.5 mt -124.91 123.47 39.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.468 -170.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.62 -168.05 2.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.528 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.9 t -76.01 73.06 2.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.395 -168.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.61 55.36 0.95 Allowed Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 167.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.78 12.77 5.61 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 162.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.6 p80 -114.14 -168.6 1.38 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.24 -177.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.96 157.84 16.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.874 160.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.634 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -112.7 131.19 55.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.035 -161.102 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.458 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 58.0 t-80 -96.44 163.56 13.0 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.371 160.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.458 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 11.5 tp10 -60.79 92.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.108 -162.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 55.25 7.55 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.614 -170.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 176.28 102.98 0.1 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 121.447 0.642 . . . . 0.0 109.876 165.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 18.0 Cg_endo -65.28 149.82 88.03 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.714 2.276 . . . . 0.0 113.627 169.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 50.6 m-85 -143.44 -178.84 6.07 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.007 169.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.5 m -56.23 138.95 49.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 113.49 -1.686 . . . . 0.0 110.802 165.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.7 -31.72 70.99 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.036 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -161.37 162.38 21.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 CA-C-N 114.715 -1.129 . . . . 0.0 109.251 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -73.36 -13.27 19.53 Favored 'Cis proline' 0 N--CA 1.483 0.856 0 C-N-CA 122.65 -1.812 . . . . 0.0 113.609 -13.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 80.7 m -59.5 -42.01 91.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.72 -156.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -66.44 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.306 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -11.64 7.88 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.42 -169.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.352 176.306 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.46 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 12.2 Cg_endo . . . . . 0 N--CA 1.485 1.025 0 N-CA-C 113.612 0.581 . . . . 0.0 113.612 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -142.28 151.16 41.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.5 172.07 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.9 t -88.01 117.74 68.8 Favored Pre-proline 0 C--O 1.251 1.155 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.253 -162.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -59.72 -22.1 66.09 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.732 2.288 . . . . 0.0 113.171 169.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -74.09 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.441 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.61 -21.26 19.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.61 -164.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.43 58.58 0.13 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.452 -170.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.15 -168.56 1.54 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.01 160.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.8 mt-10 -105.76 152.57 23.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.63 161.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -112.44 113.09 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.595 -162.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -72.84 156.27 39.06 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.371 177.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -60.35 -62.3 1.97 Allowed 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.839 -159.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -1.4 10.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.736 -173.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -102.57 14.46 31.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.422 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.96 152.86 18.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.306 -161.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.634 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.5 153.56 13.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.65 156.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.33 142.69 35.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.767 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.457 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 38.7 t -177.46 133.35 0.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.284 172.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.523 ' HB3' ' HZ2' ' A' ' 21' ' ' LYS . 3.3 mm? 59.96 32.21 21.03 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.537 -172.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.86 18.34 68.43 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 167.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HZ2' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -140.4 155.11 46.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 165.339 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.46 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.6 m-20 -86.6 176.99 7.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.305 -164.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -149.27 -175.49 5.0 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.196 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.3 m80 -100.6 140.61 34.62 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.527 169.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.685 HH12 HG21 ' A' ' 36' ' ' THR . 17.3 tpt85 -62.02 -46.52 91.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 115.206 -0.907 . . . . 0.0 109.871 -173.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.0 Cg_exo -50.01 -39.62 50.17 Favored 'Trans proline' 0 N--CA 1.484 0.967 0 C-N-CA 122.724 2.283 . . . . 0.0 113.418 169.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.81 -47.62 37.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.268 -164.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.767 HD21 ' CE1' ' A' ' 42' ' ' HIS . 4.1 tp -66.16 77.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.488 -170.108 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 29' ' ' LYS . 15.5 ptmt -138.31 141.42 39.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.393 -171.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.5 t -60.26 122.01 13.43 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 172.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 20.0 mt-10 -96.88 38.59 1.22 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.166 167.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -39.1 0.76 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.382 -177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.8 p -120.6 -27.57 5.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.056 172.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.29 47.15 5.58 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.534 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -104.25 130.58 52.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.416 167.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.685 HG21 HH12 ' A' ' 25' ' ' ARG . 85.9 m -64.39 146.83 53.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.373 167.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.0 mt -114.89 131.03 56.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.401 -167.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -78.98 -167.86 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.482 168.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -65.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.453 -168.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -127.49 56.9 0.72 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.72 10.3 3.7 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 114.997 -0.602 . . . . 0.0 111.89 166.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.767 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.1 p-80 -108.75 -170.16 1.62 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 111.026 -175.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.418 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -146.57 -163.21 1.7 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.845 168.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -171.12 132.83 0.84 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.302 174.703 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -95.24 159.3 15.08 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 154.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.68 90.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.018 -161.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.87 -44.09 1.21 Allowed Glycine 0 CA--C 1.53 1.004 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.733 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 7.2 mtmm -132.28 108.53 13.63 Favored Pre-proline 0 C--O 1.243 0.74 0 CA-C-O 121.139 0.495 . . . . 0.0 109.81 -159.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 16.1 Cg_endo -67.75 155.87 68.22 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 123.115 2.543 . . . . 0.0 113.648 165.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.3 m-85 -152.62 -162.16 1.44 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.858 169.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.3 m -57.45 139.09 54.16 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.316 162.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.61 -34.67 74.56 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.103 164.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 50.3 m80 -158.56 173.1 5.31 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.386 164.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.527 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.1 Cg_endo -63.23 -18.95 5.13 Favored 'Cis proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.466 -2.306 . . . . 0.0 112.603 -22.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.4 m -57.33 -40.36 77.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.219 -154.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -60.93 -48.31 82.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.309 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.1 t -65.52 -18.31 65.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.644 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.126 -165.835 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HD2' ' HE3' ' A' ' 21' ' ' LYS . 3.1 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.545 0.556 . . . . 0.0 113.545 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HG2' ' N ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -119.39 142.87 47.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.339 -169.198 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.9 t -78.72 118.68 73.81 Favored Pre-proline 0 C--O 1.252 1.207 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.47 -162.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -61.8 -12.0 23.43 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 123.011 2.474 . . . . 0.0 113.479 170.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.576 ' HD2' ' HD2' ' A' ' 49' ' ' PRO . 3.7 ttpp -93.52 -77.08 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.58 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.8 p -88.5 -19.47 26.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.985 -163.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.72 56.16 0.18 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.497 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.05 -172.57 2.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.013 161.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -97.55 152.78 18.67 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.68 166.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -116.34 111.71 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.549 -163.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.7 158.56 31.99 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.367 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.36 -65.86 0.62 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.803 -159.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -12.51 61.62 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.701 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.97 46.72 0.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.95 168.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.7 ptt85 -118.56 149.91 40.55 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.77 170.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 28' ' ' LEU . 19.3 m -138.62 149.25 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.554 157.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -114.06 136.99 52.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.475 -163.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 24.3 t -178.23 135.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.393 -170.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.98 17.91 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.717 -176.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.36 -24.89 30.38 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 166.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' HD2' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -114.98 164.9 13.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.843 -0.679 . . . . 0.0 110.07 179.208 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 3.8 m-20 -90.8 177.44 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.283 -165.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.0 m95 -153.03 173.72 15.07 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 113.907 -1.497 . . . . 0.0 108.99 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.7 m80 -92.08 142.65 27.28 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.466 174.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.18 -49.87 86.49 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.793 -172.415 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.6 Cg_endo -58.29 -41.02 70.66 Favored 'Trans proline' 0 N--CA 1.484 0.915 0 C-N-CA 122.551 2.168 . . . . 0.0 113.613 172.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.535 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.5 m -61.1 -48.13 83.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.213 -171.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.776 HD22 HG21 ' A' ' 16' ' ' VAL . 4.2 tp -67.71 94.3 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.379 -167.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.449 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.7 ttmt -153.16 149.46 28.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.471 -171.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -73.24 122.72 22.39 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.372 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -97.78 42.03 1.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.042 167.451 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 13.3 tptp -132.3 -49.87 0.93 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.328 172.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -109.26 -31.35 7.6 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.763 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.17 49.16 5.39 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -104.04 132.47 50.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.405 -0.397 . . . . 0.0 110.346 161.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.414 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 9.2 m -60.56 136.97 58.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.345 166.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 39.8 mt -97.89 169.66 9.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.315 -163.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.5 -174.97 2.66 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.355 -161.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -72.83 67.89 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.316 165.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.94 53.62 2.81 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 172.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.39 12.24 8.45 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 160.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.624 ' NE2' HD11 ' A' ' 28' ' ' LEU . 24.4 p-80 -110.62 -169.61 1.49 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 114.911 -0.644 . . . . 0.0 110.469 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.425 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.55 -163.28 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.72 165.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.4 pp20? -155.32 139.29 16.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.189 169.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -124.59 104.32 8.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.058 172.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 58.59 43.35 19.23 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 99.84 -20.16 50.37 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 168.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.71 99.73 14.36 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.412 0.625 . . . . 0.0 109.867 -167.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.576 ' HD2' ' HD2' ' A' ' 5' ' ' LYS . 9.7 Cg_endo -66.1 153.9 76.25 Favored 'Trans proline' 0 N--CA 1.484 0.948 0 C-N-CA 122.429 2.086 . . . . 0.0 113.602 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 38.3 m-85 -151.46 -165.75 2.33 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.04 167.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.6 m -57.61 132.26 52.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.99 -1.459 . . . . 0.0 110.395 165.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.86 -36.27 78.74 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.917 162.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 60.4 m80 -152.8 168.49 11.32 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.134 161.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 20.1 Cg_endo -67.57 -22.79 7.88 Favored 'Cis proline' 0 N--CA 1.489 1.232 0 C-N-CA 122.43 -1.904 . . . . 0.0 112.838 -17.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.4 m -56.96 -41.2 77.9 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.286 -153.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.39 -61.39 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.368 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.38 23.96 3.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.516 -166.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.354 172.345 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.575 ' H2 ' ' HE2' ' A' ' 2' ' ' LYS . 1.1 Cg_endo . . . . . 0 N--CA 1.487 1.12 0 N-CA-C 113.5 0.539 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.575 ' HE2' ' H2 ' ' A' ' 1' ' ' PRO . 3.4 mmtt -130.72 139.48 50.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.378 172.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 28.7 t -82.92 122.84 78.19 Favored Pre-proline 0 C--O 1.25 1.097 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.178 -162.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -62.63 -30.97 79.54 Favored 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.99 2.46 . . . . 0.0 113.23 169.015 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -71.08 0.23 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.394 -176.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.9 -22.75 16.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.601 -164.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 72.4 68.37 0.13 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.456 -168.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 -168.23 1.91 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.208 162.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.69 151.41 23.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.341 164.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 62.9 t -120.41 111.25 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.846 -162.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.0 163.6 25.74 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.431 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.57 -59.44 5.4 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.887 -160.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.641 -176.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.644 ' O ' HG13 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -108.03 37.87 2.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.058 166.314 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.801 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -118.69 131.84 56.15 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.943 163.751 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 28' ' ' LEU . 19.9 m -112.04 167.62 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.508 156.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 m -126.58 138.03 53.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.546 -167.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 35.6 t -177.42 137.5 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.395 -177.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.516 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 60.01 17.94 7.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.689 -177.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.13 -24.95 29.48 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.569 -1.013 . . . . 0.0 110.569 166.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.0 160.84 19.11 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 114.883 -0.658 . . . . 0.0 110.129 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.4 m-20 -88.42 177.03 6.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.271 -165.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -150.15 163.14 38.98 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.067 -1.424 . . . . 0.0 109.362 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -82.88 138.45 33.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.347 170.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.91 -46.69 96.81 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.779 -169.083 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_exo -54.59 -43.8 55.59 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 122.697 2.265 . . . . 0.0 113.537 169.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.83 -49.81 74.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.306 -169.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.539 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -68.16 88.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.376 -168.761 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.3 142.47 27.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.333 -169.987 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -60.12 122.13 13.65 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.466 171.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.578 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 27.1 mt-10 -96.32 38.23 1.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.964 165.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.79 -50.84 1.24 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.046 175.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.9 p -112.08 -20.42 11.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.874 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.8 44.4 20.03 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -100.58 127.18 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.335 169.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 72.0 m -61.44 139.8 58.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.412 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 42' ' ' HIS . 77.9 mt -104.32 116.55 32.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.292 -169.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -118.57 -171.23 2.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.531 -172.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 t 57.83 -90.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.098 163.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.36 43.15 0.07 OUTLIER Glycine 0 CA--C 1.533 1.18 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 161.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.7 24.24 15.62 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -167.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 37' ' ' LEU . 36.1 p-80 -101.16 -169.41 1.69 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.597 -0.802 . . . . 0.0 110.52 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.38 158.32 7.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.816 162.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp20? -115.05 133.65 55.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.025 -159.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.437 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 69.2 t60 -102.7 162.64 12.76 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 157.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.437 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 3.9 mm-40 -60.67 90.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.169 -161.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.77 -19.08 12.56 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.757 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -141.1 105.37 6.13 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-O 121.254 0.55 . . . . 0.0 109.773 -162.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.6 Cg_endo -66.43 161.08 42.54 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.872 2.381 . . . . 0.0 113.62 165.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -159.14 -171.18 3.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.0 173.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.5 m -58.08 139.54 54.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 113.666 -1.606 . . . . 0.0 110.321 165.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -60.36 -35.44 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.261 164.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.409 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 32.7 m80 -156.35 171.3 7.54 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.378 167.306 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 25.2 Cg_endo -62.65 -18.11 4.64 Favored 'Cis proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.135 -2.444 . . . . 0.0 112.539 -24.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.2 m -57.61 -41.74 81.86 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.129 -154.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -61.06 -60.02 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.294 174.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.409 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -70.97 -11.4 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.433 -168.577 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.372 177.061 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.484 0.97 0 N-CA-C 113.571 0.566 . . . . 0.0 113.571 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -123.88 146.98 48.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.466 -169.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.2 t -83.41 117.0 67.36 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.275 -165.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.608 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.63 -22.08 73.57 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.786 2.324 . . . . 0.0 113.238 169.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.44 -73.57 0.27 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.451 -175.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -92.11 -22.54 19.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.526 -167.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t0 72.99 60.48 0.1 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.555 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.45 -169.23 1.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.068 159.316 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.76 153.1 18.49 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.477 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.7 t -112.71 112.98 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.573 -167.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -69.0 152.69 44.93 Favored 'General case' 0 C--N 1.335 -0.065 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.212 175.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -59.97 4.55 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.712 -158.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.86 -0.29 10.92 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.581 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.42 15.49 28.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.336 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -96.89 153.41 17.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.248 -161.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.61 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -146.2 149.16 16.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.692 157.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.72 136.82 48.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.753 -169.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.444 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.45 138.77 0.23 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.31 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.46 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 59.98 23.95 13.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.663 -176.119 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.16 -24.78 28.6 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 166.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -115.43 163.5 15.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.793 -0.704 . . . . 0.0 110.247 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.466 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.73 176.02 7.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.418 -168.537 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.608 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 32.2 m95 -147.28 -177.54 5.74 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.115 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -102.42 141.06 35.85 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.521 169.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.563 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 11.5 mtm180 -60.88 -50.84 83.21 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.896 -171.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 7.0 Cg_exo -50.54 -36.83 50.86 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.386 2.057 . . . . 0.0 113.521 171.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.34 -52.28 23.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.372 -168.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 42' ' ' HIS . 3.9 tp -64.4 92.23 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.374 -167.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.452 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 pttp -150.15 147.97 28.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.455 -170.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -64.65 121.42 14.44 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.29 171.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.474 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -95.36 44.91 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.033 163.562 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -137.18 -45.26 0.56 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.352 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.6 p -115.62 -33.53 5.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.924 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.45 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 81.67 50.15 5.11 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.72 129.1 55.92 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.248 158.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.8 m -61.3 136.95 58.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.286 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 14.9 mt -92.09 134.61 34.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.351 -161.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.71 HG22 ' OG ' ' A' ' 39' ' ' SER . 80.2 m -97.37 146.36 25.25 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.937 175.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.71 ' OG ' HG22 ' A' ' 38' ' ' THR . 28.3 m 61.24 -156.14 0.35 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.952 159.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -89.99 54.92 3.67 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 156.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -105.45 14.08 47.12 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.789 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.8 p80 -113.1 -167.39 1.18 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-N 113.927 -1.137 . . . . 0.0 110.469 173.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.89 159.87 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.301 160.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.449 ' CG ' ' HG ' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -126.1 122.65 36.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.069 -165.101 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -92.65 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.935 161.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.46 42.25 21.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.832 170.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 23.59 61.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -119.54 84.78 30.72 Favored Pre-proline 0 CA--C 1.541 0.621 0 CA-C-O 121.547 0.689 . . . . 0.0 109.825 176.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.409 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 11.1 Cg_endo -63.61 148.74 92.15 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.511 2.141 . . . . 0.0 113.761 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 52.2 m-85 -154.49 -167.37 2.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.971 171.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.1 m -57.12 133.44 55.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 113.496 -1.684 . . . . 0.0 110.499 163.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -60.97 -25.5 66.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.003 162.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.494 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 21.7 m80 -166.63 162.69 11.41 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.356 169.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -71.28 -13.83 15.24 Favored 'Cis proline' 0 N--CA 1.482 0.831 0 C-N-CA 122.5 -1.875 . . . . 0.0 113.509 -15.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.0 m -59.7 -43.41 94.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.65 -156.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -60.9 -54.43 45.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.494 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.494 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -77.72 -16.01 58.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.358 -167.462 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.258 -177.821 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.442 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 20.9 Cg_exo . . . . . 0 N--CA 1.486 1.034 0 N-CA-C 113.615 0.583 . . . . 0.0 113.615 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.95 160.03 27.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.416 -167.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -85.92 121.11 73.07 Favored Pre-proline 0 C--O 1.251 1.148 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.096 -164.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.579 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -61.25 -28.9 85.52 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 C-N-CA 122.724 2.283 . . . . 0.0 113.163 169.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -70.07 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.426 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.45 -22.13 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.619 -166.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 72.59 54.45 0.15 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.475 -171.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -168.71 1.36 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 159.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 152.88 23.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.583 161.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -112.7 112.32 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.54 -162.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -75.54 159.76 30.91 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.361 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -60.45 -62.42 1.87 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.778 -159.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.58 11.11 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.688 -173.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -101.99 13.75 33.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.505 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -97.04 151.07 20.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.36 -160.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.37 156.2 15.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.736 156.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.93 137.13 52.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.667 -169.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.436 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 42.4 t -174.14 136.82 0.52 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.271 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.99 18.75 7.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.618 -172.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.58 28.37 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.39 155.24 19.31 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 114.89 -0.655 . . . . 0.0 110.184 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.442 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.2 m-20 -88.5 177.19 6.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.323 -166.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 26.6 m95 -149.17 -175.74 5.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.153 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -98.67 145.55 26.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.463 168.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.553 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.74 -44.86 96.46 Favored Pre-proline 0 CA--C 1.545 0.774 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.838 -166.445 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -64.71 -35.58 45.65 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.532 2.155 . . . . 0.0 113.547 173.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.22 -44.35 84.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.339 -163.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.546 HD12 ' HG3' ' A' ' 49' ' ' PRO . 3.8 tp -60.73 82.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.354 -174.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.57 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 10.7 ttmt -148.58 144.88 27.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.14 -0.937 . . . . 0.0 110.331 -162.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -65.02 126.17 27.2 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.536 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -96.88 27.37 4.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.065 166.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.44 -35.78 2.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.279 -175.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -126.09 -25.98 3.47 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.062 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.58 49.47 6.62 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -175.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.03 124.2 45.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.317 164.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.57 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 95.4 m -61.18 135.09 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.164 167.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.693 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.4 mt -100.58 139.47 36.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.392 -164.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 73.5 m -60.62 154.35 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.184 163.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.6 t -66.29 62.69 0.04 OUTLIER 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.486 160.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 146.95 144.74 4.08 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.371 -162.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.91 13.53 83.55 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 119.853 -1.165 . . . . 0.0 111.483 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.693 ' HB2' HD13 ' A' ' 37' ' ' LEU . 50.1 p-80 -112.22 -170.0 1.58 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 114.667 -0.767 . . . . 0.0 110.813 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -152.04 -162.77 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.604 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.592 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.5 tt0 -170.02 138.1 1.68 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.183 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -96.49 173.03 7.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.775 157.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 89.01 0.21 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.083 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.07 -65.95 0.33 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -168.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -152.61 144.78 16.79 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-O 121.521 0.677 . . . . 0.0 109.96 -162.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.592 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.4 Cg_endo -72.73 171.26 17.65 Favored 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.834 2.356 . . . . 0.0 113.62 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 29.5 m-85 -155.94 -164.55 1.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.241 165.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.4 m -57.91 135.68 56.93 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.258 162.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -60.85 -34.52 74.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.054 162.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.456 ' CD2' ' CB ' ' A' ' 57' ' ' SER . 64.2 m80 -157.6 164.25 22.11 Favored Pre-proline 0 CA--C 1.552 1.03 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.335 166.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.47 -15.69 16.93 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.584 -1.84 . . . . 0.0 113.534 -14.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.0 m -59.57 -41.91 91.28 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.826 -156.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.409 ' CD2' ' CB ' ' A' ' 43' ' ' ALA . 9.6 t80 -61.18 -56.94 14.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.452 172.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.456 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 16.7 t -62.99 -20.51 65.35 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.372 -171.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.184 -166.143 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.402 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 10.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.64 0.592 . . . . 0.0 113.64 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 147.36 41.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.405 -170.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.6 t -85.64 118.94 71.57 Favored Pre-proline 0 C--O 1.25 1.13 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.178 -164.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.574 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.0 Cg_endo -59.49 -27.51 85.14 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 122.518 2.145 . . . . 0.0 113.131 169.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -72.63 -70.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.448 -174.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -96.78 -21.92 17.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.626 -165.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 72.33 53.18 0.17 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.544 -173.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -112.72 -169.06 1.41 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.944 159.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -101.98 151.01 22.63 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.596 163.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 46.8 t -110.55 110.69 33.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.616 -167.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.43 161.67 29.03 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.385 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -60.15 -62.3 1.97 Allowed 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -158.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.14 60.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.731 -175.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -104.39 49.26 0.82 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.861 167.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 143.13 45.85 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.504 -1.225 . . . . 0.0 110.601 170.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 m -132.5 117.93 33.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.442 152.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.1 m -97.75 142.43 29.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.402 -173.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.1 t -177.72 137.27 0.2 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.089 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.843 HD23 ' OE2' ' A' ' 44' ' ' GLU . 4.6 mp 60.27 16.88 6.52 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.431 -1.258 . . . . 0.0 110.603 -172.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.99 -25.63 24.74 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 164.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -117.17 149.67 39.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.807 -0.696 . . . . 0.0 110.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -85.7 177.69 7.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.193 -165.298 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.574 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.2 m95 -151.49 -176.59 5.65 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.483 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.2 m80 -97.71 150.21 21.45 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.59 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.7 ttt180 -61.3 -48.87 90.14 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.83 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 3.9 Cg_exo -66.85 -26.27 44.75 Favored 'Trans proline' 0 N--CA 1.484 0.931 0 C-N-CA 122.502 2.134 . . . . 0.0 113.569 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.55 -51.97 10.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.228 -164.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.567 HD12 ' CD2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -61.92 91.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.403 -160.844 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.517 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 mtpp -145.76 153.39 40.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.327 -172.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -65.23 122.42 17.07 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.242 163.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -96.0 28.53 3.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.117 169.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -50.42 2.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.074 177.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.9 p -112.26 -20.25 11.93 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.916 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.46 40.12 20.01 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 126.36 41.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.435 -0.383 . . . . 0.0 110.326 167.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.4 m -61.08 137.21 58.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.27 168.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 46.1 mt -99.64 161.24 13.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -164.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -98.73 -163.53 1.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.229 -166.227 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.567 ' H ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -93.49 20.86 6.78 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.471 -177.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.22 55.34 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.34 12.77 4.34 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 170.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 12.6 p80 -106.73 -168.94 1.48 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.707 -0.747 . . . . 0.0 110.745 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -150.61 -169.97 3.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.991 165.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.843 ' OE2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -132.21 141.24 48.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.124 170.775 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -139.92 101.54 4.2 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.846 175.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 58.62 46.42 14.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.627 -169.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 63.54 19.36 62.4 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.611 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.92 98.5 42.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 121.199 0.523 . . . . 0.0 109.73 169.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 11.3 Cg_endo -54.94 141.37 78.42 Favored 'Trans proline' 0 N--CA 1.487 1.088 0 C-N-CA 122.055 1.837 . . . . 0.0 113.446 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 97.5 m-85 -150.49 -179.23 7.05 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.106 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.8 m -56.72 131.16 48.34 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.472 165.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.97 -33.64 73.52 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.886 161.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.555 ' CD2' ' HB3' ' A' ' 57' ' ' SER . 65.3 m80 -155.94 164.83 20.01 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.258 163.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.8 Cg_endo -73.06 -16.82 17.48 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.696 -1.793 . . . . 0.0 113.616 -13.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.7 m -59.59 -43.92 93.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.778 -156.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -61.11 -55.34 33.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.316 177.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.555 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 29.6 t -80.94 -16.79 52.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.469 -165.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.309 -178.139 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.419 ' H2 ' ' H ' ' A' ' 2' ' ' LYS . 3.6 Cg_endo . . . . . 0 N--CA 1.484 0.931 0 N-CA-C 113.568 0.564 . . . . 0.0 113.568 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.419 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -138.17 139.95 39.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.443 170.751 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.1 t -86.07 115.64 62.68 Favored Pre-proline 0 C--O 1.25 1.114 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.258 -164.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.573 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -60.05 -16.79 41.34 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 C-N-CA 122.771 2.314 . . . . 0.0 113.313 170.113 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -69.21 0.67 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.52 -171.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -94.21 -21.44 19.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.608 -170.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.34 52.1 0.18 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.496 -171.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.06 -168.49 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.856 160.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -106.51 152.08 24.15 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.606 161.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -111.65 111.85 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.653 -164.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.483 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 6.2 t80 -75.46 157.84 33.47 Favored 'General case' 0 N--CA 1.458 -0.054 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.311 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -59.78 -62.1 2.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 -157.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.55 -11.32 60.86 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.671 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.483 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.2 pt-20 -102.73 42.97 1.1 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.17 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.89 149.87 29.25 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.454 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.3 m -141.44 148.63 20.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.627 155.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.55 137.61 50.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.657 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 15.8 t -176.33 128.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.336 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 59.93 35.37 21.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.605 -170.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.82 18.04 52.13 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HG2' ' N ' ' A' ' 22' ' ' ASP . 20.7 ttmt -137.11 153.61 50.48 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 164.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 m-20 -88.68 177.08 6.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.392 -165.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.573 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 23.4 m95 -151.15 -173.25 4.44 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.954 -177.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -102.94 146.03 28.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 113.894 -1.503 . . . . 0.0 110.54 169.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.6 OUTLIER -60.91 -50.13 86.23 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.862 -169.204 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 6.5 Cg_exo -62.42 -34.8 75.44 Favored 'Trans proline' 0 N--CA 1.484 0.933 0 C-N-CA 122.549 2.166 . . . . 0.0 113.49 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.77 -52.9 58.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.232 -167.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.866 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.1 tp -60.42 93.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.253 -164.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.543 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.1 mttp -148.15 139.1 23.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.356 -164.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.2 t -65.66 120.81 13.63 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.354 166.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 5.7 pt-20 -98.69 39.74 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.755 167.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HD2' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -132.18 -39.32 1.06 Allowed 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.288 179.238 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -119.89 -22.2 6.87 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.12 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.99 41.44 12.32 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -95.19 122.55 37.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.49 -0.355 . . . . 0.0 110.372 167.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 90.8 m -61.09 135.62 57.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.317 170.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.733 ' O ' HD23 ' A' ' 28' ' ' LEU . 87.1 mt -101.7 97.83 8.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.314 -167.274 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.4 t -60.05 -160.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.352 161.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -68.94 0.2 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.611 170.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.91 -161.99 9.8 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 154.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.53 69.16 0.36 Allowed Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 165.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.866 ' CE1' HD21 ' A' ' 28' ' ' LEU . 48.7 p-80 -90.77 -170.83 2.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.912 -0.644 . . . . 0.0 110.951 169.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.422 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -165.28 -168.9 1.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.196 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.9 pp20? -152.88 139.7 19.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.057 -169.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -137.25 106.61 6.08 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.856 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.38 33.19 22.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.906 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.46 -27.57 10.48 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 166.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 103.01 20.55 Favored Pre-proline 0 C--O 1.244 0.771 0 CA-C-O 121.328 0.585 . . . . 0.0 109.845 -170.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.57 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.7 Cg_endo -63.75 147.81 92.33 Favored 'Trans proline' 0 N--CA 1.484 0.923 0 C-N-CA 122.485 2.123 . . . . 0.0 113.669 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 4.3 m-85 -139.89 -165.27 1.86 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.78 164.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.9 m -57.56 135.11 56.63 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.099 159.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.433 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 13.6 t-20 -62.81 -33.0 74.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.927 161.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.443 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 21.6 m-70 -157.29 162.41 27.5 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.408 169.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -71.54 -14.9 15.59 Favored 'Cis proline' 0 N--CA 1.482 0.826 0 C-N-CA 122.548 -1.855 . . . . 0.0 113.477 -14.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.3 m -59.84 -45.95 90.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.691 -156.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -60.84 -53.61 55.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.454 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.443 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.5 p -66.96 -28.71 68.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.334 -170.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.302 -169.53 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.604 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 2.4 Cg_endo . . . . . 0 N--CA 1.487 1.106 0 N-CA-C 113.457 0.522 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.23 139.0 52.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.471 170.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.4 t -85.77 116.63 66.42 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.144 -165.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.616 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -60.33 -23.55 74.86 Favored 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 122.723 2.282 . . . . 0.0 113.283 169.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -70.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.466 -174.147 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -94.91 -22.08 18.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.658 -167.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.48 57.58 0.14 Allowed 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.521 -171.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -117.19 -168.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.919 160.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -104.42 153.61 20.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.688 162.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.913 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -113.04 114.21 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.537 -163.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -71.99 156.38 39.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.396 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -60.51 -62.26 1.99 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.837 -159.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.37 -1.17 9.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.688 -173.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.82 14.81 31.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.432 178.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.31 152.05 19.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.286 -161.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.491 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.73 150.12 16.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.646 155.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 m -113.58 135.14 54.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.803 -168.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.7 t -177.69 139.62 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.422 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.09 30.24 19.73 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.629 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.42 18.49 79.38 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 166.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -152.79 164.7 37.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.448 -0.376 . . . . 0.0 110.163 166.579 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 3.8 m-20 -90.65 176.79 6.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.392 -166.27 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.616 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.9 m95 -147.45 -176.71 5.35 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.166 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.913 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.3 m80 -101.36 142.62 32.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.499 168.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.72 -45.37 96.95 Favored Pre-proline 0 CA--C 1.543 0.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.819 -168.172 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 6.6 Cg_endo -62.96 -34.03 72.56 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.513 2.142 . . . . 0.0 113.647 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -67.48 -56.02 11.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.279 -166.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.769 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.1 tp -60.59 89.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.391 -164.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.54 146.32 29.4 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.418 -174.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.3 t -60.12 124.71 21.09 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.354 170.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 50' ' ' TYR . 1.3 tm-20 -96.34 20.1 10.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.133 169.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -105.32 -60.24 1.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.317 166.366 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.6 p -105.81 -21.54 13.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.825 -168.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.5 39.85 20.72 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.38 121.41 37.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.903 0.382 . . . . 0.0 110.194 166.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.99 132.51 54.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.288 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.596 HD13 ' HB2' ' A' ' 42' ' ' HIS . 60.7 mt -96.8 123.2 40.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.314 -168.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.532 HG23 ' N ' ' A' ' 40' ' ' GLY . 4.7 t -60.11 -162.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.544 168.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -95.65 32.49 1.81 Allowed 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.522 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.532 ' N ' HG23 ' A' ' 38' ' ' THR . . . -168.0 143.83 8.45 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -170.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.85 13.84 83.2 Favored Glycine 0 N--CA 1.468 0.787 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.284 163.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.769 ' CE1' HD11 ' A' ' 28' ' ' LEU . 10.1 p80 -106.1 -168.72 1.47 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.581 -0.81 . . . . 0.0 110.713 169.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.453 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -157.67 -177.4 6.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.244 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -168.8 124.6 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.881 -166.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -155.39 121.46 5.14 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.694 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.47 39.51 25.0 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.796 -176.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 -21.39 37.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm -98.18 102.81 15.05 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 121.826 0.822 . . . . 0.0 109.845 -168.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.549 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 13.5 Cg_endo -59.34 147.87 89.08 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.022 1.814 . . . . 0.0 113.372 168.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 9.8 m-85 -154.92 -166.75 2.39 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.241 169.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.2 m -57.63 135.37 56.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.372 163.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -60.62 -30.92 70.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.144 162.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.526 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 30.5 m-70 -162.63 164.9 16.06 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.369 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.447 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -71.68 -14.34 15.9 Favored 'Cis proline' 0 N--CA 1.482 0.82 0 C-N-CA 122.517 -1.868 . . . . 0.0 113.586 -14.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.1 m -59.85 -42.3 93.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -156.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.09 -39.58 90.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.376 176.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.526 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 24.7 p -76.12 -18.09 59.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.206 -168.364 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.45 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 1.5 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -134.67 156.7 48.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.424 170.835 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.8 t -81.39 119.26 75.21 Favored Pre-proline 0 C--O 1.25 1.111 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.346 -161.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.19 -19.03 61.85 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 C-N-CA 122.878 2.385 . . . . 0.0 113.233 167.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.67 -77.26 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.47 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -91.5 -19.56 22.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.903 -164.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.23 55.03 0.17 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.495 -173.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -114.74 -168.64 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.995 160.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 7.7 mt-10 -104.77 153.24 21.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.546 161.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.911 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -113.21 113.27 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.492 -163.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.38 157.15 37.48 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.42 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.39 -62.38 1.9 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 -159.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.54 -1.07 9.85 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.553 -173.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -102.81 14.21 32.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.442 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.52 152.52 18.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.266 -161.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.648 HG21 HD22 ' A' ' 28' ' ' LEU . 16.3 m -145.04 147.67 18.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.578 155.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.51 137.06 52.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.675 -168.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 10.5 t -178.08 130.01 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.297 -171.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.14 28.51 18.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.538 -171.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.01 18.05 70.38 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -138.68 155.1 48.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 164.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.45 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -88.9 177.03 6.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.375 -165.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.3 m95 -150.56 -176.74 5.61 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.102 -177.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.911 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -100.57 142.38 32.11 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.448 169.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.447 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 5.8 mtm180 -61.08 -46.31 96.24 Favored Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.781 -170.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 7.9 Cg_exo -60.84 -36.1 85.45 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.608 2.205 . . . . 0.0 113.535 174.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.44 -46.89 74.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.343 -168.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.726 HD21 ' CE1' ' A' ' 42' ' ' HIS . 7.6 tp -62.88 93.07 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.441 -166.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.49 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -149.31 142.48 25.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.778 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -60.01 124.42 20.15 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.551 174.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.35 23.88 5.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.215 171.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -59.52 2.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.378 168.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.4 p -104.0 -16.15 15.4 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.863 -169.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 48.97 58.02 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -171.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -104.57 115.23 29.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.453 -0.373 . . . . 0.0 110.323 167.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.9 m -61.26 134.94 57.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.881 HD13 ' HB2' ' A' ' 42' ' ' HIS . 75.8 mt -97.46 125.81 42.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.425 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -71.6 -162.45 0.08 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.481 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.21 -15.29 32.78 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.605 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.642 ' H ' HG23 ' A' ' 38' ' ' THR . . . -159.25 -179.62 34.21 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -169.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.82 15.42 81.33 Favored Glycine 0 C--N 1.342 0.872 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.337 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.881 ' HB2' HD13 ' A' ' 37' ' ' LEU . 48.1 p-80 -109.71 -168.47 1.33 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 114.521 -0.84 . . . . 0.0 110.579 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -159.12 -169.11 2.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.332 170.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.487 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -150.77 131.69 14.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.989 -168.388 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 39.9 t60 -135.62 100.45 4.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.994 176.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 58.6 43.89 18.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.832 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.09 -21.53 44.68 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -97.89 100.94 9.48 Favored Pre-proline 0 C--O 1.242 0.686 0 CA-C-O 121.283 0.563 . . . . 0.0 109.807 -172.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 10.4 Cg_endo -62.31 164.99 16.03 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.378 2.052 . . . . 0.0 113.737 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 71.9 m-85 -161.99 176.61 10.59 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.073 -171.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.8 m -57.86 128.41 36.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.961 -1.472 . . . . 0.0 110.054 160.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -60.86 -32.93 72.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.912 162.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 28.1 m80 -154.26 161.4 29.38 Favored Pre-proline 0 CA--C 1.551 1.018 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.154 163.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -74.39 -18.25 18.21 Favored 'Cis proline' 0 C--N 1.354 0.835 0 C-N-CA 122.718 -1.784 . . . . 0.0 113.61 -12.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -58.92 -45.34 90.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.89 -154.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -61.05 -61.89 2.25 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.0 p -72.68 -11.91 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.444 -173.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.374 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.068 179.182 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.487 1.092 0 N-CA-C 113.542 0.555 . . . . 0.0 113.542 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 6.4 pttp -126.12 156.21 40.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.36 -168.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -85.28 116.97 67.76 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.126 -163.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.611 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_endo -60.16 -21.85 67.74 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.584 2.189 . . . . 0.0 113.108 169.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -72.47 0.38 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.484 -173.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.6 p -91.84 -21.16 20.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.598 -169.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.02 52.29 0.13 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.597 -171.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -108.61 -169.33 1.48 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.884 158.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.497 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -106.76 151.72 24.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.531 160.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.7 t -112.68 124.91 69.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.711 -166.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.537 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 13.1 p90 -101.29 160.31 14.52 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.488 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HA ' ' HB3' ' A' ' 15' ' ' ARG . 7.0 p90 -59.61 -40.96 89.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.89 -158.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.479 ' H ' ' HD1' ' A' ' 11' ' ' TYR . . . -81.06 -0.09 38.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.161 -163.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 0.7 OUTLIER -113.37 9.74 18.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.686 166.203 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.433 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -80.66 141.15 35.22 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.36 -159.116 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.2 m -146.82 125.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.024 160.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -98.79 142.03 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.434 -168.556 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.5 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.6 138.65 0.22 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.566 -168.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' N ' HD22 ' A' ' 19' ' ' LEU . 3.2 mm? 59.92 32.49 21.21 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.726 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.41 -24.09 21.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 168.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.4 ' CE ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.35 -174.01 2.52 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 114.864 -0.668 . . . . 0.0 110.022 177.089 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.2 m-20 -106.4 177.05 4.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.309 -173.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.611 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 37.4 m95 -149.71 -172.29 4.11 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.267 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.5 m80 -101.65 159.44 15.31 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.558 170.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -74.3 -57.05 2.31 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.717 -175.522 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.448 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 4.2 Cg_exo -49.44 -22.47 6.16 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 C-N-CA 122.282 1.988 . . . . 0.0 113.411 172.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -87.0 -58.17 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.267 -167.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.92 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -62.81 83.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.348 -173.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.5 mtmt -156.67 139.55 15.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.266 -164.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -63.12 123.47 18.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.432 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 8.0 pt-20 -97.93 27.67 4.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.819 164.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.15 -50.76 2.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.351 170.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.99 -21.23 10.16 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.955 -175.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.45 43.02 16.69 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -99.81 122.42 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.343 168.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.0 m -60.84 137.19 58.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.32 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.821 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.6 mt -101.15 148.64 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.442 -162.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.504 HG22 ' N ' ' A' ' 39' ' ' SER . 97.5 m -102.73 168.81 9.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.369 -171.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.504 ' N ' HG22 ' A' ' 38' ' ' THR . 0.1 OUTLIER -62.87 78.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.57 179.517 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.43 58.49 0.96 Allowed Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.33 9.61 1.71 Allowed Glycine 0 C--N 1.334 0.458 0 CA-C-N 114.435 -0.882 . . . . 0.0 111.996 168.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.92 ' CE1' HD11 ' A' ' 28' ' ' LEU . 6.1 p80 -112.12 -171.31 1.82 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.983 0.42 . . . . 0.0 110.555 -170.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -141.64 -164.72 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.612 166.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.478 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.75 146.74 2.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.218 162.912 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.521 ' NE2' ' HB2' ' A' ' 48' ' ' LYS . 34.2 p80 -86.96 -165.76 1.38 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.548 155.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.17 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.285 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.66 39.1 41.61 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 172.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.521 ' HB2' ' NE2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -158.34 108.39 1.69 Allowed Pre-proline 0 CA--C 1.544 0.738 0 CA-C-O 121.315 0.579 . . . . 0.0 109.804 166.351 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 11.8 Cg_endo -71.46 154.14 60.59 Favored 'Trans proline' 0 N--CA 1.483 0.878 0 C-N-CA 122.963 2.442 . . . . 0.0 113.71 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 8.4 m-85 -147.14 -164.73 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.908 164.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.8 m -57.49 138.13 55.47 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.261 161.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -60.66 -30.66 70.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.172 163.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.433 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 34.4 m80 -164.37 164.84 13.57 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.355 168.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 12.2 Cg_endo -70.91 -12.96 14.6 Favored 'Cis proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.447 -1.897 . . . . 0.0 113.556 -15.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 68.9 m -59.72 -42.55 93.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.711 -157.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CD2' ' CB ' ' A' ' 43' ' ' ALA . 23.0 t80 -60.87 -45.07 95.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.507 176.039 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.433 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 25.3 t -76.2 -25.16 54.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.527 -172.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.286 -174.591 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.486 1.065 0 N-CA-C 113.453 0.52 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.97 144.19 33.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.408 169.37 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.5 t -83.18 117.63 69.19 Favored Pre-proline 0 C--O 1.248 1.025 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.17 -162.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -60.46 -22.14 70.59 Favored 'Trans proline' 0 N--CA 1.489 1.227 0 C-N-CA 122.749 2.299 . . . . 0.0 113.222 169.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -73.25 0.31 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.396 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -94.44 -20.87 19.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.692 -165.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 t0 72.57 57.09 0.14 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.547 -172.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.95 -168.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.02 159.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.6 152.97 21.79 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.573 161.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -112.14 112.05 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.472 -163.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -75.75 159.51 30.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.382 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.34 -62.55 1.78 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.866 -159.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.48 -1.88 12.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.645 -173.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -101.86 14.08 32.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.478 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -98.74 146.31 26.02 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.374 -160.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.963 HG21 HD22 ' A' ' 28' ' ' LEU . 12.1 m -141.92 126.74 17.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.248 152.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 82.8 m -95.57 132.38 40.76 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.401 -175.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.461 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -162.65 122.58 2.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.224 -159.876 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.684 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.05 23.77 12.98 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.67 -176.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.73 17.06 66.63 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.696 -0.961 . . . . 0.0 110.696 164.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -151.21 150.38 30.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 162.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.2 178.29 8.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.252 -160.901 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.9 m95 -152.2 -177.32 6.11 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.237 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.9 m80 -101.09 143.63 30.98 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.053 -1.431 . . . . 0.0 110.526 170.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.4 ttp180 -61.18 -46.48 95.82 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.78 -173.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -58.88 -27.64 84.97 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.647 2.231 . . . . 0.0 113.585 174.137 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -81.04 -46.96 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.051 HD21 ' CE1' ' A' ' 42' ' ' HIS . 8.0 tp -60.78 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.442 -173.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 13.1 mtmt -135.9 127.48 28.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.409 -164.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -61.35 125.88 25.37 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.353 167.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.0 tp10 -95.65 30.4 2.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.123 168.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.98 -43.03 1.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.173 -177.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.3 p -120.09 -9.32 9.62 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.815 -1.084 . . . . 0.0 111.212 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.82 37.9 95.36 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -95.0 121.47 36.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.28 172.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.2 m -61.31 135.97 57.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.17 166.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 42' ' ' HIS . 27.3 mt -102.11 123.45 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.378 -165.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -84.38 -175.65 5.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.498 169.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.4 p -61.06 -9.85 5.15 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.506 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.81 ' H ' HG23 ' A' ' 38' ' ' THR . . . -63.51 -170.04 1.5 Allowed Glycine 0 CA--C 1.532 1.094 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.736 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.19 76.52 2.13 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -158.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 1.051 ' CE1' HD21 ' A' ' 28' ' ' LEU . 33.0 p-80 -98.61 -167.02 1.43 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.264 -0.968 . . . . 0.0 110.572 169.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.58 -166.67 1.54 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.799 -169.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.53 154.26 3.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.167 164.956 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.54 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 15.0 p80 -92.21 -167.66 1.81 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.533 156.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.98 91.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.173 -176.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.67 53.87 9.28 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 178.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 6.1 ttmm -179.78 106.96 0.19 Allowed Pre-proline 0 CA--C 1.541 0.613 0 CA-C-O 121.764 0.792 . . . . 0.0 110.021 165.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.8 Cg_endo -71.21 148.82 56.6 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.744 2.296 . . . . 0.0 113.665 173.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.7 m-85 -144.1 -171.91 3.66 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.767 162.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 79.5 m -58.2 137.7 56.83 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.156 165.562 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -67.88 -34.37 76.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.58 -1.191 . . . . 0.0 109.993 163.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -150.36 167.68 12.52 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.406 165.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.29 -20.39 6.64 Favored 'Cis proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.818 -2.159 . . . . 0.0 112.628 -21.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.6 m -57.31 -48.13 79.73 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.235 -153.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -61.07 -55.46 32.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.409 174.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.9 t -60.82 -17.74 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.564 -174.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.193 -168.206 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.086 0 N-CA-C 113.478 0.53 . . . . 0.0 113.478 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -145.13 136.89 25.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.277 -170.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 32.0 t -85.11 119.92 72.97 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.043 -162.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -63.25 -19.6 68.81 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 C-N-CA 122.971 2.447 . . . . 0.0 113.375 171.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.498 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 0.2 OUTLIER -85.05 -64.47 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.473 -171.053 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.5 p -96.48 -23.76 16.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.684 -170.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 72.21 64.55 0.13 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.512 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.5 OUTLIER -127.38 -170.81 2.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.105 162.019 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -99.66 150.48 22.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.306 163.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.928 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.9 t -112.58 113.64 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.505 -163.207 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -68.43 150.79 47.7 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.461 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.35 -62.82 1.59 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.834 -159.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -1.88 11.55 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.603 -174.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -101.85 13.2 35.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.302 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -96.44 155.8 16.61 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.249 -161.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.95 HG21 HD22 ' A' ' 28' ' ' LEU . 15.5 m -144.49 145.16 21.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.423 155.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -114.69 137.59 51.73 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.652 -168.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.531 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 8.7 t -177.69 128.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.334 -169.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.658 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.06 28.63 18.2 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.588 -172.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.38 17.5 72.51 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 167.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mmtt -137.22 153.19 50.45 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 163.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.41 176.77 7.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.399 -167.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.572 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 33.9 m95 -148.38 175.53 11.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 114.231 -1.35 . . . . 0.0 109.411 -177.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.928 ' CD2' HG22 ' A' ' 10' ' ' VAL . 40.5 m80 -96.81 138.97 33.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.392 167.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.7 tpp180 -60.94 -47.06 96.63 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.861 -165.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -62.23 -35.24 75.42 Favored 'Trans proline' 0 N--CA 1.484 0.914 0 C-N-CA 122.53 2.153 . . . . 0.0 113.666 174.207 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.498 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.3 m -61.21 -41.32 96.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.173 -171.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.95 HD22 HG21 ' A' ' 16' ' ' VAL . 10.2 tp -67.79 103.35 1.41 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -164.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -146.92 157.08 43.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.31 -178.519 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.1 t -72.18 127.42 32.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.367 171.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -95.83 35.87 1.35 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 114.078 -1.419 . . . . 0.0 110.168 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.502 ' HB2' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -138.08 -46.47 0.52 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.283 -176.258 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -115.87 -18.78 10.67 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.124 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.29 38.85 28.2 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -108.0 136.9 46.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.007 -0.597 . . . . 0.0 110.565 173.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -61.68 150.3 36.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.325 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.616 HD13 ' CB ' ' A' ' 42' ' ' HIS . 42.6 mt -113.28 154.9 26.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.398 -167.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -88.21 -170.57 3.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.396 -175.214 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.629 ' H ' HG22 ' A' ' 38' ' ' THR . 16.3 t -61.65 -42.37 98.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.416 -176.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.58 59.5 0.42 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -128.21 13.45 6.31 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 111.63 -0.588 . . . . 0.0 111.63 173.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.781 ' NE2' HD11 ' A' ' 28' ' ' LEU . 28.0 p-80 -114.04 -167.65 1.24 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.031 -0.584 . . . . 0.0 110.481 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -174.11 159.1 3.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.044 165.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.8 pp20? -110.3 134.96 51.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.074 -163.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -128.11 99.09 5.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.229 -1.35 . . . . 0.0 109.878 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 58.47 41.58 22.48 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.747 -173.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.435 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.18 -22.61 38.81 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 168.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -92.36 102.27 6.26 Favored Pre-proline 0 C--O 1.243 0.742 0 CA-C-O 121.253 0.549 . . . . 0.0 109.812 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 8.1 Cg_endo -58.61 167.91 4.65 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.482 2.121 . . . . 0.0 113.468 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 32.1 m-85 -164.46 170.17 16.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.892 -167.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -57.3 133.98 55.58 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 113.85 -1.523 . . . . 0.0 110.269 160.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -61.02 -27.99 68.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.07 164.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.47 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 32.6 m80 -163.8 163.79 15.55 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.354 165.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -72.36 -13.53 17.32 Favored 'Cis proline' 0 N--CA 1.482 0.824 0 C-N-CA 122.645 -1.815 . . . . 0.0 113.578 -13.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.656 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 76.2 m -59.83 -46.34 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -157.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.13 -47.91 80.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.339 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.47 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.26 -14.14 61.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.298 178.396 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . . . . . . 0 CA--C 1.534 0.328 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.183 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.488 ' HD3' ' NZ ' ' A' ' 21' ' ' LYS . 10.2 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.54 0.554 . . . . 0.0 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.429 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -118.86 159.2 24.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.423 -168.828 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.8 t -81.94 118.72 73.12 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.391 -162.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -59.24 -19.38 49.78 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.766 2.311 . . . . 0.0 113.252 167.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.562 ' HE3' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -83.36 -77.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.431 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.24 -18.8 22.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.035 -162.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 t70 71.88 51.92 0.22 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.485 -175.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -168.6 1.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.008 161.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' HG2' ' CD ' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.71 153.07 21.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.657 162.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.7 t -112.39 112.95 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.581 -163.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -70.66 154.98 41.33 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.29 177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -60.68 -62.29 1.97 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.796 -160.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.48 10.82 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.614 -173.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -102.46 14.52 31.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.475 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ptt-85 -96.42 155.13 16.89 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.214 -161.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.811 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -147.31 151.73 13.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.812 157.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.58 137.84 47.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.664 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.8 t -176.02 137.58 0.32 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.143 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.578 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 59.97 18.97 8.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.574 -171.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.45 28.93 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.488 ' NZ ' ' HD3' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -107.0 157.64 17.64 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.943 -0.629 . . . . 0.0 110.269 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.26 176.83 7.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.382 -166.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.8 m95 -149.54 -176.08 5.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.105 -177.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.0 m80 -100.36 138.61 37.19 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.91 -1.495 . . . . 0.0 110.543 169.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.465 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.3 ttp-105 -61.17 -47.6 94.23 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.803 -175.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.2 Cg_exo -52.44 -33.5 57.3 Favored 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 122.584 2.189 . . . . 0.0 113.6 170.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -77.63 -55.53 5.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.252 -170.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.811 HD22 HG21 ' A' ' 16' ' ' VAL . 3.0 tp -61.48 78.26 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.381 -175.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 ptpt -137.31 155.44 49.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.416 170.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -59.51 125.88 25.38 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.651 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -93.53 22.67 5.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.226 170.738 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.485 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.08 -60.11 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.33 166.886 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.4 p -106.32 -21.22 13.16 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.902 -167.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.84 40.98 20.12 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 124.06 33.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.445 -0.377 . . . . 0.0 110.26 165.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 36.6 m -61.56 135.84 57.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.133 166.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 95.9 mt -102.97 110.16 21.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.388 -161.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 39' ' ' SER . 4.9 t -98.86 -167.06 1.43 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.44 171.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.657 ' HB3' HG23 ' A' ' 38' ' ' THR . 24.9 p 58.79 -162.73 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.564 158.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -122.36 47.74 1.0 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 157.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -103.14 15.31 54.92 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.449 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.1 p-80 -104.6 -170.48 1.77 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.473 0.654 . . . . 0.0 111.055 176.297 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.48 -166.05 2.37 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.161 175.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -170.87 164.91 7.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.885 164.693 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.536 ' NE2' ' HG2' ' A' ' 48' ' ' LYS . 31.8 p80 -111.05 106.14 15.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.715 163.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.15 14.85 2.95 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.006 165.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.539 ' HA2' ' HB2' ' A' ' 4' ' ' PRO . . . 126.99 16.28 2.43 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.562 ' HD3' ' HE3' ' A' ' 5' ' ' LYS . 9.4 tppt? -129.66 86.49 55.38 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -173.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.566 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.4 Cg_endo -71.29 155.56 60.33 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.665 2.243 . . . . 0.0 113.721 -168.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.7 m-85 -152.99 -164.12 1.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.813 167.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.1 m -58.18 137.34 57.1 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.103 159.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -61.32 -31.58 71.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.964 162.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.589 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 47.7 m80 -161.53 164.56 18.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.34 170.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.415 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.9 Cg_endo -70.31 -11.7 13.06 Favored 'Cis proline' 0 N--CA 1.483 0.906 0 C-N-CA 122.465 -1.89 . . . . 0.0 113.365 -15.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.5 m -61.99 -45.38 93.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.685 -157.008 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -61.03 -47.49 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.425 176.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.589 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.05 -15.07 62.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.543 -176.009 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.209 -173.162 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 113.538 0.553 . . . . 0.0 113.538 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 3.1 pttt -119.76 154.88 33.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.355 -167.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.2 t -78.44 117.64 67.52 Favored Pre-proline 0 C--O 1.248 0.974 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.637 -164.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -62.7 -6.88 9.8 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 123.031 2.487 . . . . 0.0 113.397 168.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.556 ' CE ' ' HD2' ' A' ' 49' ' ' PRO . 10.8 tptp -97.69 -75.87 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.346 -178.272 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -89.89 -12.35 39.21 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.536 -168.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 p30 59.98 53.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.624 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 -168.55 1.44 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.78 157.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -110.17 155.4 22.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.518 0.675 . . . . 0.0 109.626 159.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 26.4 t -112.94 114.08 45.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.476 -157.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.04 156.0 39.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.376 177.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 15' ' ' ARG . 9.9 t80 -60.57 -59.4 5.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 -158.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.44 -0.77 13.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.571 -171.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -102.96 11.94 36.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.585 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.472 ' HD3' ' CD1' ' A' ' 12' ' ' PHE . 2.2 ptm180 -93.55 151.81 19.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.361 -160.35 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.982 HG21 HD22 ' A' ' 28' ' ' LEU . 15.9 m -145.75 145.58 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.494 155.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.22 135.45 54.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.635 -167.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.8 t -178.49 134.13 0.14 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.182 -168.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.55 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.2 mm? 59.96 18.62 7.71 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.656 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.23 -24.66 30.39 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 167.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mmpm? -110.1 159.18 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 114.815 -0.693 . . . . 0.0 110.107 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.93 176.5 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.289 -166.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.3 m95 -148.29 -179.97 7.33 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.184 -1.371 . . . . 0.0 109.106 -177.169 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -99.78 141.42 32.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.542 166.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.611 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.55 -49.44 86.96 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.177 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.611 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -59.13 -30.4 93.07 Favored 'Trans proline' 0 N--CA 1.484 0.929 0 C-N-CA 122.456 2.104 . . . . 0.0 113.74 176.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.9 -45.35 67.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.277 -175.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 HG21 ' A' ' 16' ' ' VAL . 9.8 tp -64.91 84.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.325 -167.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -136.82 141.0 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.49 -169.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -67.78 124.12 22.44 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.445 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.85 42.72 1.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.237 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.52 -37.46 0.46 Allowed 'General case' 0 C--O 1.231 0.097 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.701 -178.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -117.52 -31.06 5.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.041 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.13 51.51 4.41 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -173.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.2 126.93 52.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.901 0.381 . . . . 0.0 110.116 164.1 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.4 m -61.25 133.57 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.228 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.538 HD13 ' HB2' ' A' ' 42' ' ' HIS . 92.1 mt -94.08 143.93 25.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.421 -163.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.874 HG22 ' H ' ' A' ' 40' ' ' GLY . 95.0 m -62.56 155.84 24.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.832 161.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.476 ' OG ' HG12 ' A' ' 16' ' ' VAL . 71.1 m -60.55 -21.07 62.14 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.083 178.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.874 ' H ' HG22 ' A' ' 38' ' ' THR . . . -121.76 179.69 16.19 Favored Glycine 0 CA--C 1.527 0.836 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.537 162.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.25 13.93 82.77 Favored Glycine 0 C--N 1.342 0.878 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.174 172.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.538 ' HB2' HD13 ' A' ' 37' ' ' LEU . 46.4 p-80 -110.64 -167.33 1.17 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 113.967 -1.116 . . . . 0.0 110.468 169.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.51 160.36 7.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.151 159.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.55 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -114.88 122.46 46.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.213 -164.321 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.552 ' HB2' ' HG3' ' A' ' 48' ' ' LYS . 1.7 m80 -75.99 -168.25 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.877 160.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.39 85.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.027 -170.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.29 54.41 37.48 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.552 ' HG3' ' HB2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -168.04 105.52 0.56 Allowed Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.706 0.765 . . . . 0.0 109.935 170.35 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.556 ' HD2' ' CE ' ' A' ' 5' ' ' LYS . 14.0 Cg_endo -65.46 146.16 84.49 Favored 'Trans proline' 0 N--CA 1.484 0.92 0 C-N-CA 122.824 2.349 . . . . 0.0 113.624 169.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 22.4 m-85 -143.65 -166.05 2.24 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.843 168.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 94.5 m -57.49 129.71 43.03 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.748 -1.569 . . . . 0.0 110.278 165.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 23.0 t30 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.813 159.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 64.2 m80 -155.34 163.24 25.25 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.268 164.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.481 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -72.99 -19.13 15.7 Favored 'Cis proline' 0 C--N 1.352 0.746 0 C-N-CA 122.708 -1.788 . . . . 0.0 113.712 -11.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.1 m -59.1 -45.63 90.39 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.812 -155.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -61.17 -48.63 80.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.427 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.67 23.76 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.738 -172.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.234 174.121 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.403 ' HD2' ' OD1' ' A' ' 22' ' ' ASP . 23.2 Cg_exo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 113.589 0.573 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.47 159.21 26.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.545 -166.374 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.0 t -88.04 118.78 70.03 Favored Pre-proline 0 C--O 1.25 1.131 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.221 -162.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -58.81 -23.76 68.53 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.788 2.325 . . . . 0.0 113.14 169.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.79 -73.99 0.28 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.421 -176.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -94.42 -22.05 18.54 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.632 -164.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 71.93 61.6 0.14 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.556 -169.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.71 -167.76 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.058 162.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -103.36 147.66 26.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.299 163.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 49.1 t -109.46 111.97 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.68 -166.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.01 160.77 30.12 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.392 177.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.57 -63.02 1.44 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.75 -160.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.26 -11.0 60.59 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.71 -174.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.22 40.58 1.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.284 172.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.2 149.72 28.97 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.47 -176.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.496 HG21 HD22 ' A' ' 28' ' ' LEU . 18.3 m -143.47 145.71 22.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.475 155.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -113.81 139.5 49.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.546 -166.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.415 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 36.8 t -178.1 131.66 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.314 -171.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.621 HD21 ' OE1' ' A' ' 44' ' ' GLU . 3.1 mm? 59.99 18.82 7.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.551 -171.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.77 -24.47 26.04 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -105.33 157.72 17.13 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.808 -0.696 . . . . 0.0 110.026 179.262 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.403 ' OD1' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -92.16 177.47 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.299 -163.565 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.5 m95 -151.87 -175.13 5.1 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.067 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -101.16 144.83 29.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.474 169.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 34.6 tpt85 -61.62 -48.84 89.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.714 -170.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.4 Cg_endo -59.98 -31.71 93.96 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.597 2.198 . . . . 0.0 113.634 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -71.61 -44.99 63.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.278 -167.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.651 HD21 ' CE1' ' A' ' 42' ' ' HIS . 6.9 tp -66.48 77.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.441 -167.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -133.73 146.76 51.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.283 -173.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.9 t -60.19 128.81 38.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.403 169.168 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.501 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.2 mm-40 -99.85 26.13 6.61 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.129 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.82 -60.33 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.351 164.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.6 p -99.99 -20.41 16.1 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.766 -170.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.79 42.91 24.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.4 mmtt -119.04 130.01 55.41 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.988 -0.606 . . . . 0.0 110.373 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 m -61.43 149.85 37.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.449 -173.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.554 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 64.9 mt -110.63 125.59 53.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.378 -166.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -83.54 -166.84 1.49 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.705 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t -95.31 35.59 1.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 -165.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.49 58.44 0.01 OUTLIER Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 160.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -139.24 11.21 3.29 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 114.672 -0.764 . . . . 0.0 111.838 163.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.651 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.3 p-80 -113.46 -169.54 1.52 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.201 -0.5 . . . . 0.0 110.982 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 42' ' ' HIS . . . -146.75 -166.86 2.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.816 -1.083 . . . . 0.0 110.05 168.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.621 ' OE1' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.38 134.83 33.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.168 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.453 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 55.7 t-80 -114.46 162.52 16.57 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 161.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.453 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 50.5 mm-40 -60.06 90.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.332 -160.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.47 25.71 6.85 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 174.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.542 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 176.45 140.43 0.22 Allowed Pre-proline 0 C--O 1.242 0.705 0 CA-C-O 121.264 0.554 . . . . 0.0 109.778 161.497 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.651 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.6 Cg_endo -66.96 161.0 44.43 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 123.038 2.492 . . . . 0.0 113.609 164.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.542 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 65.0 m-85 -150.4 -173.88 4.59 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.881 168.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.8 m -58.12 132.52 53.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 113.789 -1.55 . . . . 0.0 110.159 161.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.442 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 14.0 t-20 -61.12 -33.2 73.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.882 164.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.449 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 53.6 m80 -158.35 162.89 25.97 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.318 163.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.28 -18.18 16.81 Favored 'Cis proline' 0 C--N 1.353 0.81 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.646 -11.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 82.7 m -59.24 -43.14 92.41 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.907 -154.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.98 -61.31 2.67 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.376 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -35.67 81.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.456 -174.001 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.185 -167.251 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo . . . . . 0 N--CA 1.483 0.904 0 N-CA-C 113.595 0.575 . . . . 0.0 113.595 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.08 147.85 51.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.477 171.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -85.13 121.25 74.04 Favored Pre-proline 0 C--O 1.25 1.126 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.044 -166.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.595 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.22 -33.27 90.56 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 122.888 2.392 . . . . 0.0 113.097 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -63.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.42 -168.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -97.78 -24.17 15.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.749 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 72.6 57.33 0.13 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.519 -171.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.32 -168.75 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.972 160.486 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -104.35 153.69 20.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.637 161.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.4 t -112.94 112.03 38.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.546 -163.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.487 ' CZ ' ' CE1' ' A' ' 12' ' ' PHE . 14.2 t80 -73.14 155.17 39.93 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.181 177.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.2 -59.44 5.41 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -158.827 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 -0.43 12.94 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.506 -172.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -105.81 17.81 23.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.353 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -96.3 152.09 18.91 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.249 -163.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.463 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.92 145.35 21.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.59 156.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -115.38 137.11 52.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.517 -165.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 t -178.46 128.04 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.247 -170.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.84 36.02 21.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.627 -171.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.12 17.9 53.39 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 168.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.69 156.49 47.36 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 164.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.18 176.69 6.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.319 -165.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.595 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.6 m95 -149.63 -176.84 5.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.12 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -99.93 146.5 26.6 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 113.954 -1.475 . . . . 0.0 110.585 168.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -61.02 -48.35 92.73 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.774 -168.234 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.3 Cg_endo -63.63 -35.31 59.4 Favored 'Trans proline' 0 N--CA 1.483 0.868 0 C-N-CA 122.555 2.17 . . . . 0.0 113.638 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.95 -50.73 65.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.209 -164.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.817 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -60.31 89.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.353 -163.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.494 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 57.3 mttt -148.69 149.81 32.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.393 -165.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.9 t -69.04 126.43 29.77 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.451 175.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.9 33.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.066 169.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' NZ ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -130.25 -49.53 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.198 179.104 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.447 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 29.3 p -113.5 -18.49 11.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.214 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.97 39.7 53.65 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -99.29 131.42 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.302 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 28.3 m -60.87 139.57 57.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.465 171.214 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 51.7 mt -103.07 121.75 43.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.359 -169.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -83.25 -169.08 2.36 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.48 -173.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.1 p -74.47 77.39 1.93 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.376 -167.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.42 56.1 1.72 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 168.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.75 11.87 4.25 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 166.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.817 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.2 p80 -107.36 -170.32 1.68 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.106 -0.547 . . . . 0.0 110.451 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.87 158.7 10.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.833 163.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 17.8 pt-20 -112.77 128.33 56.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.211 -160.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.479 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.44 151.97 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.419 157.015 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -62.67 75.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.003 -172.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.449 ' HA3' ' NZ ' ' A' ' 48' ' ' LYS . . . 162.45 -53.52 0.31 Allowed Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.715 -167.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -155.16 140.48 12.37 Favored Pre-proline 0 C--O 1.242 0.68 0 CA-C-O 121.39 0.614 . . . . 0.0 110.048 -163.81 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.9 Cg_endo -68.46 149.35 74.64 Favored 'Trans proline' 0 N--CA 1.486 1.032 0 C-N-CA 123.08 2.52 . . . . 0.0 113.708 166.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 8.4 m-85 -138.8 -173.65 3.62 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.79 167.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 86.0 m -57.52 134.59 56.24 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 113.458 -1.701 . . . . 0.0 110.348 164.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.88 -37.15 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.021 162.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.517 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 64.3 m80 -152.68 169.82 9.04 Favored Pre-proline 0 CA--C 1.546 0.81 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 163.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.517 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 22.2 Cg_endo -66.12 -21.47 7.17 Favored 'Cis proline' 0 N--CA 1.491 1.347 0 C-N-CA 122.113 -2.036 . . . . 0.0 112.655 -19.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 73.4 m -57.11 -42.92 81.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.251 -153.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -61.03 -56.32 22.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.458 175.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.98 24.28 6.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.507 -166.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.256 174.01 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.428 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 5.3 Cg_exo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.59 158.77 29.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.355 -167.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.3 t -80.59 119.36 76.04 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.349 -161.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -61.1 -18.83 60.42 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.877 2.385 . . . . 0.0 113.198 167.852 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.452 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.9 OUTLIER -83.02 -77.65 0.24 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.424 -179.428 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -90.96 -20.12 22.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.918 -164.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.22 52.54 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.463 -173.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.81 -168.13 1.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.979 159.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 149.59 27.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.355 167.035 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.5 t -111.31 113.53 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.467 -161.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.4 ' HB3' ' CG ' ' A' ' 14' ' ' GLU . 1.4 t80 -77.7 158.75 29.53 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.457 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.11 -62.71 1.67 Allowed 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 -158.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.21 -13.29 61.87 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.813 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HB3' ' A' ' 11' ' ' TYR . 1.9 pm0 -102.78 52.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.783 167.176 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -115.81 148.63 39.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.527 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.856 HG21 HD22 ' A' ' 28' ' ' LEU . 10.2 m -137.35 141.25 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.478 151.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.8 m -105.34 131.03 53.29 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.523 -176.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -168.71 122.72 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.197 -164.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.654 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.17 32.97 21.08 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.77 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.93 18.5 78.71 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 163.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -154.72 160.05 41.1 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 164.372 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.428 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -85.75 176.89 7.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.285 -165.31 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.6 m95 -152.91 -176.45 5.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.03 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 39.2 m80 -101.76 142.26 33.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.476 168.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -61.16 -50.59 83.47 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.732 -169.469 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 7.3 Cg_exo -57.38 -34.93 98.75 Favored 'Trans proline' 0 N--CA 1.483 0.9 0 C-N-CA 122.618 2.212 . . . . 0.0 113.545 174.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.8 m -65.74 -46.47 78.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.352 -169.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.028 HD21 ' CE1' ' A' ' 42' ' ' HIS . 11.3 tp -60.84 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.332 -165.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -139.73 146.63 39.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.327 -164.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.0 t -70.66 119.77 15.3 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 167.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -97.71 29.03 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.988 165.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tptp -110.48 -52.35 2.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.116 170.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.8 -24.36 10.91 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.752 -177.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.72 44.62 7.17 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 2.4 mmtm -111.15 119.82 40.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.306 -0.447 . . . . 0.0 110.401 168.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.5 m -61.08 161.72 8.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.319 168.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.879 HD13 ' HB2' ' A' ' 42' ' ' HIS . 5.0 mt -131.78 147.32 52.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.351 -165.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -83.47 -166.2 1.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.586 174.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.0 t -95.76 32.11 1.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.346 -169.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 167.22 57.36 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 164.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.25 12.0 2.29 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 114.763 -0.718 . . . . 0.0 111.825 170.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 1.028 ' CE1' HD21 ' A' ' 28' ' ' LEU . 24.9 p-80 -112.75 -174.62 2.49 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.47 -175.424 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.62 -177.27 6.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 164.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.547 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 mp0 -140.72 114.77 9.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.059 -164.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.493 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -74.0 -167.84 0.54 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.821 157.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.39 86.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.199 -173.431 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.25 47.34 91.58 Favored Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.734 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.9 103.26 1.93 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 121.851 0.834 . . . . 0.0 109.848 -175.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 12.3 Cg_endo -66.87 145.2 73.76 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 122.594 2.196 . . . . 0.0 113.79 177.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -143.63 -168.32 2.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.848 171.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 69.2 m -57.51 134.56 56.2 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.197 161.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -61.28 -33.48 73.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.89 160.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 63.1 m80 -157.13 163.81 23.78 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.193 164.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.3 Cg_endo -73.2 -17.42 17.31 Favored 'Cis proline' 0 C--N 1.354 0.828 0 C-N-CA 122.627 -1.822 . . . . 0.0 113.558 -14.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.3 m -59.5 -38.06 79.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.723 -155.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -62.35 -54.8 35.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.385 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.741 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 2.0 t -61.83 -12.69 18.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.464 -173.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.287 -179.169 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.099 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -131.11 156.41 45.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.432 170.872 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.1 t -83.09 118.93 73.18 Favored Pre-proline 0 C--O 1.25 1.086 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.435 -162.78 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.6 Cg_endo -60.15 -19.62 57.66 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.754 2.303 . . . . 0.0 113.373 167.806 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.08 -77.29 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.466 179.519 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.58 -19.74 21.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.725 -163.256 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 16.2 t70 71.78 64.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.455 -170.403 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -126.08 -168.01 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.167 162.722 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -103.93 148.83 25.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.289 163.759 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 56.1 t -115.92 110.95 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.723 -164.036 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.496 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 27.0 t80 -72.74 154.95 40.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.374 -179.314 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.496 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 15.9 m-85 -60.28 -61.38 2.64 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.945 -158.568 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.78 -1.18 13.1 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.613 -173.015 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -102.4 12.17 36.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.547 178.046 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -97.11 158.19 15.56 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.178 -160.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.818 HG21 HD22 ' A' ' 28' ' ' LEU . 17.7 m -146.53 145.94 19.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.471 156.386 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -114.39 137.42 51.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.904 -1.043 . . . . 0.0 110.669 -166.117 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.0 t -178.35 127.48 0.12 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.235 -171.239 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 59.94 34.87 21.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.557 -170.172 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.75 18.0 51.51 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.541 -1.023 . . . . 0.0 110.541 169.313 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.44 153.15 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 164.674 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.427 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.68 177.17 6.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.289 -165.535 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 26.1 m95 -150.39 175.56 11.73 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.064 -1.425 . . . . 0.0 109.383 -177.705 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.8 m80 -93.37 137.64 32.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.526 171.144 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.56 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 ttp180 -61.03 -46.43 96.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.83 -170.693 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -50.36 -48.32 20.61 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.704 2.269 . . . . 0.0 113.496 166.867 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.77 -51.53 67.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.231 -166.376 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.818 HD22 HG21 ' A' ' 16' ' ' VAL . 3.2 tp -60.24 91.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.404 -162.13 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.7 mtpt -140.96 154.18 45.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.357 -169.372 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.0 t -69.45 132.05 45.72 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.376 176.809 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HB2' ' CZ ' ' A' ' 50' ' ' TYR . 45.1 mm-40 -95.43 31.31 2.01 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.194 -1.367 . . . . 0.0 110.261 173.437 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.33 -48.54 0.53 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.189 -174.343 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.1 p -114.1 -10.74 12.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.245 178.724 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.41 23.35 77.56 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 172.936 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -103.74 136.23 43.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.911 -0.645 . . . . 0.0 110.402 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 m -61.94 142.56 57.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.451 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.533 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 60.1 mt -99.92 157.77 16.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.422 -173.082 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -101.9 -172.39 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.221 -167.748 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER -60.98 -22.09 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.445 -167.59 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 174.68 60.76 0.05 OUTLIER Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 170.927 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -115.2 11.61 19.8 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 166.807 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.472 ' CE1' HD21 ' A' ' 28' ' ' LEU . 21.9 p-80 -102.04 -168.61 1.56 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.389 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.36 158.64 11.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.958 161.897 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.576 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -121.18 138.99 53.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.1 -163.632 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -130.43 109.21 10.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.76 173.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.488 ' HB3' ' HD2' ' A' ' 48' ' ' LYS . 1.4 tp10 58.4 43.34 19.91 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.663 -170.463 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.84 22.65 73.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -117.64 98.43 51.7 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-N 115.159 -0.52 . . . . 0.0 109.759 173.195 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.7 Cg_endo -64.33 155.18 67.14 Favored 'Trans proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.62 2.213 . . . . 0.0 113.572 -173.941 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 31' ' ' GLU . 76.3 m-85 -151.6 177.63 10.15 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.001 175.431 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.0 m -56.52 132.08 50.46 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.379 -1.737 . . . . 0.0 110.426 161.979 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.64 -30.06 69.64 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.978 163.332 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.593 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 51.3 m80 -160.87 165.17 17.76 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.699 -1.137 . . . . 0.0 109.323 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.474 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.0 Cg_endo -72.89 -15.0 17.89 Favored 'Cis proline' 0 N--CA 1.483 0.898 0 C-N-CA 122.628 -1.822 . . . . 0.0 113.608 -13.394 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.6 m -59.54 -44.34 93.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.714 -157.02 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -61.78 -51.0 70.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.517 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.593 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -73.79 -15.25 61.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.342 -176.219 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.354 173.421 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.437 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 8.7 Cg_exo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.5 0.538 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HD3' ' HG2' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -119.52 155.99 31.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.413 -167.414 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.0 t -83.7 119.42 73.64 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.417 -164.887 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.6 Cg_endo -62.0 -17.78 57.87 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.794 2.329 . . . . 0.0 113.261 167.547 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.485 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -83.27 -76.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.449 179.593 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -92.79 -20.25 20.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.825 -163.19 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 t0 72.46 59.51 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.468 -171.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.53 -176.35 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.993 160.725 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.416 ' HG2' ' HD3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -98.26 148.0 24.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.528 172.816 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.1 t -111.96 112.96 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.546 -158.53 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 19.1 t80 -73.14 151.44 41.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.41 -179.343 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.41 -54.63 43.34 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.875 -159.211 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.91 -1.22 27.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.522 -170.115 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 13.22 28.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.339 175.73 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.45 153.49 22.45 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.283 -165.921 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -147.84 147.57 17.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.787 156.721 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -113.84 136.06 53.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.666 -168.136 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.1 t -177.74 131.33 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.417 -173.614 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.607 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.1 mm? 60.12 36.0 21.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.719 -175.918 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.11 18.59 67.13 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.9 157.84 43.88 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 165.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.437 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 4.1 m-20 -89.78 176.7 6.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.29 -168.344 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -149.49 179.13 8.2 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.101 -177.041 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -96.27 142.99 27.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.445 170.66 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.568 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 15.0 tpt180 -61.28 -45.22 95.15 Favored Pre-proline 0 CA--C 1.543 0.689 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.728 -166.369 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.5 Cg_endo -64.81 -37.17 36.48 Favored 'Trans proline' 0 N--CA 1.483 0.893 0 C-N-CA 122.586 2.191 . . . . 0.0 113.604 175.107 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.485 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.4 m -61.08 -48.31 82.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.208 -166.35 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.63 HD21 ' CE1' ' A' ' 42' ' ' HIS . 6.6 tp -60.4 89.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.425 -163.319 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.513 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 mttt -143.46 144.06 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.3 -165.595 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.6 t -63.25 119.52 9.78 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.47 167.413 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 6.9 pt-20 -97.22 35.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.758 164.037 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HE2' ' HE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -120.35 -48.71 2.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.205 173.161 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -112.6 -22.71 10.63 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 114.541 -1.208 . . . . 0.0 110.994 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.27 42.81 9.06 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -178.092 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -97.65 133.63 41.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.364 169.773 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.503 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 14.0 m -69.06 143.17 54.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.313 167.847 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.828 HD13 ' HB2' ' A' ' 42' ' ' HIS . 85.0 mt -109.19 158.88 17.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.262 -167.478 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -116.74 -169.05 1.56 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.549 -166.149 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.9 t -60.84 -23.1 64.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 -165.554 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.88 70.69 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -136.27 22.45 3.39 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 163.907 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.828 ' HB2' HD13 ' A' ' 37' ' ' LEU . 31.6 p-80 -111.33 -168.43 1.31 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 114.792 -0.704 . . . . 0.0 110.486 -177.961 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -147.87 -166.64 2.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.776 165.661 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.607 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -163.13 137.81 6.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.077 162.624 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -103.09 112.68 25.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.831 166.053 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 58.28 31.7 21.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.742 165.836 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 116.35 -20.12 12.66 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.579 -1.008 . . . . 0.0 110.579 170.041 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -104.92 94.21 7.3 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 121.408 0.623 . . . . 0.0 109.853 -169.175 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.3 Cg_endo -64.44 158.07 51.37 Favored 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.374 2.05 . . . . 0.0 113.597 -177.081 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 88.2 m-85 -155.4 -164.6 1.8 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.074 174.304 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 98.1 m -56.48 135.52 54.31 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.435 161.458 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -61.12 -30.92 70.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.885 161.69 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.536 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 29.8 m-70 -161.65 164.97 17.21 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.333 165.915 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.3 -15.24 16.79 Favored 'Cis proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.529 -1.863 . . . . 0.0 113.555 -14.679 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.68 -40.34 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.657 -156.645 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -60.98 -35.61 77.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.471 172.755 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.1 t -84.58 -13.54 51.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.338 -174.295 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.229 -177.474 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.584 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 7.1 Cg_exo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 113.528 0.549 . . . . 0.0 113.528 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -147.05 136.47 22.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.485 -166.458 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -93.52 118.77 67.6 Favored Pre-proline 0 C--O 1.247 0.957 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.157 -167.741 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.66 -27.43 84.81 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.839 2.359 . . . . 0.0 113.196 168.779 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -73.02 0.19 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.388 -176.441 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.14 -16.2 22.77 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -165.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.23 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.569 -169.0 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 -167.82 1.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.01 158.332 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.31 145.58 30.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.379 165.984 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 48.5 t -107.71 110.25 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.746 -165.502 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -73.8 157.4 36.47 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -60.66 -63.13 1.4 Allowed 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.763 -160.007 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -3.83 19.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.372 -1.286 . . . . 0.0 111.79 -174.368 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.18 16.1 26.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 178.696 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -97.69 149.64 22.06 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.28 -163.543 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.781 HG21 HD22 ' A' ' 28' ' ' LEU . 12.5 m -142.2 119.07 6.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.483 154.683 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.7 m -88.05 133.36 33.99 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.287 -176.528 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.711 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.5 OUTLIER -160.9 120.67 2.69 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.337 -161.047 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.624 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.7 mm? 60.02 18.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.721 -177.641 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.21 -26.11 12.77 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 162.968 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.77 147.49 43.82 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.873 -0.663 . . . . 0.0 109.95 178.85 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -79.06 177.51 8.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.191 -163.264 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 46.2 m95 -151.46 -178.32 6.6 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 113.972 -1.467 . . . . 0.0 109.371 -177.339 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.1 m80 -98.49 145.59 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.488 171.86 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -62.62 -49.9 80.82 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.833 -173.512 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.7 Cg_exo -61.56 -32.28 87.69 Favored 'Trans proline' 0 N--CA 1.482 0.835 0 C-N-CA 122.744 2.296 . . . . 0.0 113.604 176.506 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -70.2 -49.49 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.149 -168.989 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.105 HD21 ' CE1' ' A' ' 42' ' ' HIS . 5.3 tp -64.51 82.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.329 -162.771 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -124.24 142.47 51.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.301 -170.074 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.6 t -63.24 128.62 36.67 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.37 170.533 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG3' ' HG2' ' A' ' 48' ' ' LYS . 4.9 mm-40 -95.81 37.32 1.22 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.159 169.626 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.38 -50.39 0.56 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.257 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -112.19 -18.75 12.48 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.043 -179.738 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.42 40.27 60.33 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 174.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -111.88 134.98 53.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.154 -0.523 . . . . 0.0 110.495 171.556 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 m -61.56 147.13 46.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.381 176.368 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 11.4 mt -109.23 170.25 8.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.355 -166.907 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 39' ' ' SER . 1.3 m -108.01 174.57 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.424 -165.404 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.442 ' H ' HG22 ' A' ' 38' ' ' THR . 7.1 t -64.98 69.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.371 171.118 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.71 55.42 1.65 Allowed Glycine 0 CA--C 1.531 1.045 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.3 12.84 5.74 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.589 -0.605 . . . . 0.0 111.589 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 1.105 ' CE1' HD21 ' A' ' 28' ' ' LEU . 34.4 p-80 -115.14 -168.93 1.46 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.781 -0.71 . . . . 0.0 110.257 -177.609 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.67 157.78 12.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.894 161.403 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.574 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.46 128.68 56.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.007 -163.851 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.459 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.3 t60 -90.37 163.4 14.72 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.303 160.857 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.459 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 2.1 tt0 -60.43 92.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.119 -161.974 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.71 54.67 11.53 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.63 -169.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -179.74 101.84 0.18 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-O 121.451 0.643 . . . . 0.0 109.884 166.953 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.574 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.9 Cg_endo -65.1 150.25 88.06 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.803 2.335 . . . . 0.0 113.639 170.813 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 47.5 m-85 -147.61 -179.57 6.97 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.914 169.938 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.9 m -56.28 140.89 43.4 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.295 -1.775 . . . . 0.0 110.592 164.239 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -61.01 -32.95 72.52 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.12 168.426 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 45.0 m80 -162.73 165.63 14.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.339 166.362 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.472 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -71.5 -11.33 15.39 Favored 'Cis proline' 0 C--N 1.354 0.831 0 C-N-CA 122.52 -1.866 . . . . 0.0 113.616 -14.344 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.4 m -59.82 -45.75 91.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 -157.842 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -61.28 -65.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.275 -178.436 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.413 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 73.1 m -65.27 -12.84 55.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.47 -170.237 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.426 171.599 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.88 148.12 49.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.36 -171.386 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.3 t -76.09 118.33 70.44 Favored Pre-proline 0 C--O 1.246 0.906 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.505 -163.469 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.601 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -60.22 -18.62 53.03 Favored 'Trans proline' 0 N--CA 1.489 1.21 0 C-N-CA 122.96 2.44 . . . . 0.0 113.211 167.295 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -84.99 -77.4 0.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.46 -178.14 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.8 p -89.87 -13.07 37.21 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.455 -167.231 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 60.2 54.59 3.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.574 -173.16 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.465 ' HA ' ' HD2' ' A' ' 8' ' ' LYS . 6.5 tptp -108.47 -168.37 1.35 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.767 157.081 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.96 155.3 18.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.595 161.527 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.7 t -114.24 113.28 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.504 -163.66 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.426 ' CE1' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t80 -73.35 157.79 36.3 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.359 177.076 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CE2' ' CE1' ' A' ' 11' ' ' TYR . 5.8 m-85 -60.55 -61.89 2.26 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.77 -159.819 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.38 -1.22 9.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.616 -173.22 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.557 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 15.8 mm-40 -101.96 12.98 36.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.69 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.24 152.12 18.64 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.277 -160.295 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.91 150.04 15.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.662 156.379 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 138.84 44.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.816 -170.677 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.453 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 27.8 t -177.3 132.76 0.17 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.341 178.007 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.634 HD23 ' OE1' ' A' ' 44' ' ' GLU . 3.4 mm? 60.15 38.0 20.51 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.533 -175.536 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.36 18.67 63.42 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 166.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -145.19 158.89 43.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.595 -0.302 . . . . 0.0 110.2 166.398 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.14 177.15 6.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.374 -167.729 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.601 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.84 -174.71 4.78 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 114.162 -1.381 . . . . 0.0 108.993 -177.991 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.0 m80 -100.9 142.38 32.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 113.803 -1.544 . . . . 0.0 110.555 170.136 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.6 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.23 -44.81 94.67 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.116 -174.211 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.6 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 6.0 Cg_endo -62.65 -28.65 77.03 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.503 2.135 . . . . 0.0 113.652 175.417 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.32 -50.85 11.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.294 -168.821 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.488 HD22 HG21 ' A' ' 16' ' ' VAL . 1.4 tp -65.2 75.78 0.05 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.301 -177.55 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 8.6 ttmt -147.52 139.54 24.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.431 -174.728 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.8 t -61.19 125.67 24.58 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.317 178.217 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HE1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -100.7 21.8 12.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.13 172.91 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HZ1' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -104.4 -58.6 1.86 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.162 166.063 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.404 ' HA ' ' HZ1' ' A' ' 32' ' ' LYS . 31.5 p -102.31 -33.34 9.63 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.407 -172.805 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.51 49.51 4.6 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.506 178.588 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.515 ' HB2' ' NZ ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -106.59 126.87 52.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.417 161.352 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.55 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 67.7 m -61.86 136.33 57.94 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.176 172.162 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 42' ' ' HIS . 34.3 mt -96.43 165.91 11.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.371 -160.726 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 39' ' ' SER . 2.0 m -112.12 177.93 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.296 -164.076 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 38' ' ' THR . 48.8 m -60.72 84.04 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.526 170.215 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 55.79 7.31 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 172.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -132.03 12.23 5.32 Favored Glycine 0 CA--C 1.524 0.651 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.608 162.665 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.563 ' CB ' HD13 ' A' ' 37' ' ' LEU . 32.7 p-80 -105.48 -168.53 1.47 Allowed 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 114.72 -0.74 . . . . 0.0 110.399 177.336 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.66 157.58 8.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.804 160.079 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.634 ' OE1' HD23 ' A' ' 19' ' ' LEU . 5.7 pt-20 -120.83 125.48 47.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.131 -161.576 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.472 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 83.4 t60 -93.4 164.65 13.12 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 158.178 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.472 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 15.3 mm-40 -58.09 93.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 -157.124 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.0 56.38 5.82 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.746 -172.313 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HE2' ' NZ ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER 179.14 98.86 0.17 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-O 121.755 0.788 . . . . 0.0 110.02 163.009 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.471 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 32.5 Cg_endo -68.52 137.84 40.41 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.974 2.449 . . . . 0.0 113.503 166.06 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.9 m-85 -133.85 -163.8 1.41 Allowed 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.67 171.383 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.9 m -56.37 134.16 53.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.451 163.521 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -60.93 -31.11 70.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.024 163.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.497 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 19.4 m-70 -158.62 166.39 16.57 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.206 164.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -66.26 -21.71 7.22 Favored 'Cis proline' 0 N--CA 1.49 1.276 0 C-N-CA 121.992 -2.087 . . . . 0.0 112.733 -20.726 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.9 m -56.54 -39.12 72.86 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.386 -152.821 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -64.73 -71.84 0.17 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.033 174.336 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.497 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 20.4 m -62.41 -14.16 37.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.54 -166.505 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.236 -173.845 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.491 0.535 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.4 149.0 47.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.29 169.488 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.1 t -83.55 117.27 68.17 Favored Pre-proline 0 C--O 1.249 1.047 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.221 -162.347 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.5 Cg_endo -59.46 -23.08 69.1 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.418 2.079 . . . . 0.0 113.069 169.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HG2' ' HD2' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -77.51 -72.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.545 -175.44 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.34 -20.45 19.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.755 -165.788 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.78 57.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.506 -172.882 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -118.57 -168.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.92 159.789 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -104.35 154.14 20.19 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.434 160.797 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 31.7 t -112.27 111.99 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.45 -162.21 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.57 33.1 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.554 -1.203 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -51.21 70.81 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.007 -156.453 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -0.37 29.33 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.444 -168.183 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -111.05 20.96 16.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.304 173.084 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.84 148.0 24.86 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.355 -169.717 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.95 117.53 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.661 154.256 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -97.34 142.58 29.04 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.521 -173.136 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.6 t -177.26 137.36 0.22 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.212 -169.268 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 4.7 mp 60.13 16.4 5.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.553 -172.874 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.6 -25.82 23.24 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 165.555 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.94 149.72 41.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 114.721 -0.739 . . . . 0.0 110.158 -178.135 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -85.76 177.53 7.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.217 -162.611 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 42.2 m95 -149.18 -175.84 5.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.376 179.27 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.6 m80 -98.22 148.52 23.52 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.468 173.389 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 tpp85 -61.58 -45.25 93.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.716 -168.689 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.0 Cg_endo -66.17 -40.28 15.87 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.538 2.159 . . . . 0.0 113.581 174.674 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.61 -53.26 59.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.301 -163.832 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 37' ' ' LEU . 1.6 tp -60.51 91.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.414 -163.015 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 mtmp? -152.18 148.05 27.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.353 -170.375 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.9 t -61.63 126.87 28.87 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.485 173.369 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.74 21.29 11.61 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.163 176.031 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.13 -61.25 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.358 165.952 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.0 p -100.54 -22.76 14.88 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.569 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.53 45.18 11.34 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.537 -1.025 . . . . 0.0 110.537 -175.842 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -99.99 120.98 40.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.463 . . . . 0.0 110.298 165.677 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.5 m -61.23 131.0 49.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.302 175.903 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 28' ' ' LEU . 21.3 mt -94.57 118.08 31.13 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 114.618 -1.173 . . . . 0.0 110.38 -174.024 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -60.15 -168.46 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.549 169.63 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -87.15 69.1 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.245 165.988 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 156.01 151.7 6.0 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.651 176.107 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.06 15.42 81.11 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.107 -1.044 . . . . 0.0 111.355 167.06 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.654 ' HB2' HD13 ' A' ' 37' ' ' LEU . 21.5 p80 -110.83 -166.51 1.08 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.722 -0.739 . . . . 0.0 110.853 172.343 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.452 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.95 159.63 9.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.191 -170.964 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.539 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -135.63 122.53 21.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.006 -165.092 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -128.86 102.15 6.41 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.197 -1.365 . . . . 0.0 109.972 177.037 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 58.6 47.47 13.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.643 -171.736 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.87 19.87 56.53 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.578 173.535 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HA ' ' HZ1' ' A' ' 5' ' ' LYS . 12.9 mmtm -110.4 98.38 35.92 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 170.347 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.616 ' HB2' HD12 ' A' ' 37' ' ' LEU . 9.7 Cg_endo -62.17 157.82 42.78 Favored 'Trans proline' 0 N--CA 1.486 1.042 0 C-N-CA 122.47 2.113 . . . . 0.0 113.638 -173.14 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 57.0 m-85 -158.32 173.55 16.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.994 -170.528 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.4 m -57.87 130.88 48.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.051 160.201 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -61.52 -31.91 71.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.81 160.718 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.481 ' CD2' ' CB ' ' A' ' 57' ' ' SER . 62.5 m80 -157.12 163.2 25.82 Favored Pre-proline 0 CA--C 1.553 1.076 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.162 165.07 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.428 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.71 -16.73 18.65 Favored 'Cis proline' 0 C--N 1.353 0.788 0 C-N-CA 122.665 -1.806 . . . . 0.0 113.651 -13.316 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.6 m -59.36 -44.99 92.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.711 -156.298 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -60.83 -52.73 63.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.507 174.456 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.481 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 7.6 t -63.31 -29.15 70.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.38 -173.421 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -170.524 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.466 ' H2 ' ' HD2' ' A' ' 2' ' ' LYS . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.946 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.55 158.2 22.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -168.619 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.8 t -86.84 122.75 71.3 Favored Pre-proline 0 C--O 1.247 0.972 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.165 -162.445 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.62 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -62.03 -30.18 82.59 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.846 2.364 . . . . 0.0 113.288 168.971 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -70.87 0.28 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.476 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -96.65 -14.22 22.27 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.485 -166.307 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.5 57.12 3.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.58 -169.362 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.71 -168.01 1.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.853 158.929 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -107.69 152.14 24.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.608 162.013 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.9 t -111.2 112.47 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.615 -163.636 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.35 152.98 44.65 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.308 175.596 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -60.52 3.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.777 -158.759 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.53 -11.8 61.05 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.744 -172.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.426 ' H ' ' HG2' ' A' ' 14' ' ' GLU . 3.9 pt-20 -102.81 42.6 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.173 170.984 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -108.82 152.72 24.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.384 -178.447 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.536 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -143.73 145.72 21.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.602 155.965 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.7 136.48 50.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.668 -166.204 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.422 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.0 t -177.99 136.45 0.17 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.466 -173.573 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.435 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.13 25.09 14.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.645 -177.671 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.75 -24.69 28.48 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 166.574 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 2' ' ' LYS . 3.3 tttp -118.09 165.98 13.11 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.752 -0.724 . . . . 0.0 110.21 -178.049 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.27 176.56 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.376 -166.293 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.62 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.4 m95 -148.53 -176.8 5.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 114.165 -1.379 . . . . 0.0 109.171 -178.882 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.932 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.4 m80 -102.98 141.83 35.11 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.473 169.309 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.96 -47.82 94.41 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.835 -174.549 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_exo -54.74 -27.3 51.43 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 C-N-CA 122.59 2.193 . . . . 0.0 113.609 172.624 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -83.38 -55.25 4.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.263 -167.63 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.551 HD21 ' CE1' ' A' ' 42' ' ' HIS . 3.4 tp -60.71 82.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.388 -171.126 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.75 144.9 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.393 -164.515 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.7 t -64.85 133.61 52.27 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.399 -171.281 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.34 25.42 6.28 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.439 175.143 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.476 ' HA ' ' NZ ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -130.68 -48.87 1.05 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.64 -179.597 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.8 p -109.68 -18.3 13.5 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.3 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.82 40.28 85.05 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 176.668 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.14 134.87 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.432 -0.384 . . . . 0.0 110.456 170.071 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.8 m -61.52 145.24 52.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.378 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.467 HD13 ' CB ' ' A' ' 42' ' ' HIS . 18.5 mt -106.9 143.31 35.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.398 -171.699 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -110.41 -169.45 1.47 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.523 -170.48 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.3 84.45 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 -167.476 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.87 55.52 4.12 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 167.39 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.58 12.28 4.58 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 167.919 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.551 ' CE1' HD21 ' A' ' 28' ' ' LEU . 28.5 p-80 -108.09 -170.36 1.67 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.135 -0.533 . . . . 0.0 110.498 -178.96 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -177.96 157.13 1.12 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.423 161.278 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.492 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -136.96 153.25 50.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.07 -157.889 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 10.3 p80 -98.2 167.66 10.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.551 157.25 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.84 86.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.123 -170.643 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.49 -48.77 0.71 Allowed Glycine 0 CA--C 1.529 0.916 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.566 -178.362 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 3.6 mttt -137.33 111.53 9.17 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 121.439 0.638 . . . . 0.0 109.764 -160.225 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.492 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 15.3 Cg_endo -68.91 154.11 71.49 Favored 'Trans proline' 0 N--CA 1.484 0.959 0 C-N-CA 122.963 2.442 . . . . 0.0 113.599 167.805 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -143.21 -167.82 2.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.827 163.777 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.1 m -56.56 140.24 47.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.34 -1.754 . . . . 0.0 110.453 164.044 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.66 -34.81 74.85 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 114.407 -1.269 . . . . 0.0 110.118 164.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.713 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 51.1 m80 -161.8 166.2 14.95 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.275 165.454 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.529 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.8 Cg_endo -71.81 -13.75 16.23 Favored 'Cis proline' 0 N--CA 1.481 0.783 0 C-N-CA 122.681 -1.8 . . . . 0.0 113.631 -12.309 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.1 m -59.68 -41.18 90.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.769 -157.194 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -61.17 -36.6 80.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.374 177.012 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.713 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -77.28 -28.48 53.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.342 -179.92 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.317 -167.937 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.55 0.558 . . . . 0.0 113.55 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -125.5 153.53 43.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.458 -168.928 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.9 t -77.36 117.59 66.37 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.438 -163.813 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.0 Cg_endo -62.11 -9.92 16.31 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 123.001 2.467 . . . . 0.0 113.344 168.133 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.98 -74.38 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.446 -177.295 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -91.94 -19.35 22.54 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.973 -167.875 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.4 t0 72.3 49.17 0.23 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.594 -177.229 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -106.13 -168.39 1.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.839 159.325 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.1 mt-10 -107.03 157.49 17.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.457 158.565 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 25.4 t -114.49 112.5 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.252 -159.68 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -73.79 159.51 32.81 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.189 -179.507 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -60.21 -63.08 1.43 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.85 -158.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -2.98 15.1 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.661 -174.173 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -101.79 15.59 28.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.264 178.976 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.41 138.96 36.76 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.478 -163.398 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.2 m -132.72 117.71 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.523 154.178 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 46.6 m -89.79 133.05 34.91 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.209 -176.117 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -161.51 125.91 3.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.376 -159.759 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.857 HD23 ' HG2' ' A' ' 44' ' ' GLU . 5.5 mp 59.98 19.67 8.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.764 167.137 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 124.42 -31.43 4.42 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 162.469 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -135.42 158.98 43.01 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 114.653 -0.774 . . . . 0.0 110.082 -177.188 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.32 178.06 8.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.236 -164.568 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 40.2 m95 -151.38 -177.48 6.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 113.791 -1.549 . . . . 0.0 109.216 -178.767 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -99.63 147.83 24.96 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.485 171.799 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 10.6 mmt180 -61.16 -48.77 90.97 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.712 -168.827 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 3.6 Cg_exo -64.56 -36.19 44.15 Favored 'Trans proline' 0 N--CA 1.483 0.901 0 C-N-CA 122.618 2.212 . . . . 0.0 113.613 175.772 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.436 ' HA ' ' NZ ' ' A' ' 29' ' ' LYS . 1.6 m -64.59 -54.06 38.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -165.335 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.829 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -62.73 90.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.374 -166.088 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.0 OUTLIER -140.74 152.03 44.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.414 -171.355 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -64.27 128.66 36.77 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.293 171.866 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 6.3 tp10 -95.7 35.25 1.39 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.199 171.859 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.47 -52.08 0.7 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.9 p -109.77 -17.57 13.64 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.17 -178.247 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.26 33.43 44.46 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.68 137.11 32.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.275 -0.462 . . . . 0.0 110.414 171.492 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.2 m -66.45 137.3 56.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.309 167.772 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.545 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 28.4 mt -100.05 149.95 22.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.394 -167.304 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -89.62 -162.42 0.88 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.63 -173.288 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -95.71 36.69 1.26 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.355 -174.7 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.2 57.83 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 164.486 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.68 12.97 4.52 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 166.37 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.829 ' NE2' HD21 ' A' ' 28' ' ' LEU . 7.3 p80 -111.66 -169.01 1.38 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 114.621 -0.789 . . . . 0.0 110.657 178.838 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -169.55 159.39 8.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.995 164.679 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.857 ' HG2' HD23 ' A' ' 19' ' ' LEU . 16.7 pt-20 -113.96 132.99 55.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.009 -161.677 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.498 ' CE1' ' CD1' ' A' ' 56' ' ' TYR . 0.7 OUTLIER -90.41 74.95 6.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.231 174.056 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 58.37 40.95 23.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.903 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.47 21.11 35.63 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.524 -1.03 . . . . 0.0 110.524 177.146 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.42 95.86 46.54 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-O 121.248 0.547 . . . . 0.0 109.794 168.294 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.545 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 9.3 Cg_endo -64.26 152.86 79.59 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 C-N-CA 122.577 2.185 . . . . 0.0 113.63 -167.49 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 90.9 m-85 -153.94 173.12 16.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.886 173.323 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 75.8 m -56.96 133.18 54.58 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.408 163.592 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -61.25 -35.28 76.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.075 163.823 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m-70 -153.02 167.32 13.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.25 163.05 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.2 Cg_endo -66.83 -21.4 7.77 Favored 'Cis proline' 0 N--CA 1.488 1.179 0 C-N-CA 122.394 -1.919 . . . . 0.0 112.807 -17.245 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.4 m -56.73 -48.79 76.98 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.282 -153.866 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.498 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 10.1 t80 -60.98 -49.76 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.505 -178.735 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.41 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 25.0 p -72.06 -19.15 61.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.461 -175.921 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.178 -167.356 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 113.516 0.545 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.96 134.39 44.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.419 -168.608 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 34.1 t -81.61 123.16 80.95 Favored Pre-proline 0 C--O 1.251 1.15 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.076 -165.304 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -63.8 -28.13 67.9 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 123.092 2.528 . . . . 0.0 113.25 169.852 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -70.61 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.415 -178.237 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -99.24 -26.08 14.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.716 -162.92 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.77 67.13 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.508 -167.58 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 6.9 tptp -125.51 -168.99 1.92 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.039 160.761 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -100.84 149.81 23.46 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.64 165.283 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.5 t -119.01 122.45 69.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.544 -163.518 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.529 ' HB3' ' HG3' ' A' ' 14' ' ' GLU . 26.9 t80 -88.36 152.09 22.16 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.387 -172.84 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HA ' ' HG3' ' A' ' 15' ' ' ARG . 90.4 m-85 -58.44 -59.51 5.24 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.468 -154.077 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -13.98 59.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.653 -174.166 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -107.1 42.87 1.23 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.563 164.923 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.917 ' HG2' HG12 ' A' ' 10' ' ' VAL . 11.6 mtt85 -99.75 170.59 8.45 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.128 161.351 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.674 HG21 HD22 ' A' ' 28' ' ' LEU . 19.8 m -150.08 149.06 14.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.524 153.892 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -115.13 136.8 52.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.841 -167.624 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 t -178.57 126.89 0.11 Allowed 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.991 -165.742 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 59.39 19.15 7.44 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.74 -170.629 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.7 -24.46 30.77 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 166.86 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -105.11 158.3 16.67 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.033 -0.584 . . . . 0.0 110.159 178.009 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -91.48 176.88 6.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.259 -166.873 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.563 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.1 m95 -153.15 166.34 32.81 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 114.016 -1.447 . . . . 0.0 109.149 -176.42 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -83.04 136.93 34.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.588 168.347 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.452 ' HG3' HG13 ' A' ' 16' ' ' VAL . 6.9 mtp180 -60.88 -43.81 92.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.95 -172.404 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -59.51 -37.15 90.81 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.596 2.197 . . . . 0.0 113.638 172.515 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.3 m -69.22 -47.62 64.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.161 -167.08 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.697 HD21 ' CE1' ' A' ' 42' ' ' HIS . 6.0 tp -60.6 86.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.391 -166.313 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.5 mtmm -145.46 142.17 29.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.367 -167.241 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -61.56 129.74 42.6 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.386 172.823 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -95.15 22.55 6.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.197 171.705 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 2.7 tptt -130.46 -35.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.464 -167.582 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.8 -17.78 5.78 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.342 171.789 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.46 41.45 51.79 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 177.707 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -109.11 136.97 47.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.437 172.384 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -61.04 148.37 40.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.472 177.817 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.2 mt -110.41 135.1 51.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.316 -168.012 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -93.46 -168.32 1.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.488 -167.091 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -60.66 -29.46 69.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.554 -164.976 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.82 62.03 0.1 Allowed Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -173.64 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.76 11.63 3.42 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.007 -0.596 . . . . 0.0 111.781 167.109 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.697 ' CE1' HD21 ' A' ' 28' ' ' LEU . 47.9 p-80 -106.83 -169.45 1.55 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.823 -0.689 . . . . 0.0 110.711 178.887 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.43 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -149.51 -166.91 2.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.586 164.685 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 8.4 pt-20 -133.03 135.68 45.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.405 166.865 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.432 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.3 t60 -103.14 161.77 13.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 157.637 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.432 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 4.7 mt-10 -60.36 91.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.243 -159.429 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 136.91 -52.1 0.78 Allowed Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -174.616 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.0 144.52 35.51 Favored Pre-proline 0 C--O 1.242 0.695 0 CA-C-O 121.324 0.583 . . . . 0.0 109.939 -160.769 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.555 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -69.45 162.93 39.96 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.952 2.434 . . . . 0.0 113.675 169.527 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 94.2 m-85 -156.3 -170.76 3.46 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.913 166.274 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.1 m -58.0 130.47 46.69 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.755 -1.566 . . . . 0.0 110.117 163.666 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -60.64 -32.66 71.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.993 163.56 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 54.0 m80 -158.65 162.77 26.02 Favored Pre-proline 0 CA--C 1.551 0.991 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.254 162.731 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -73.61 -18.76 16.74 Favored 'Cis proline' 0 C--N 1.354 0.838 0 C-N-CA 122.651 -1.812 . . . . 0.0 113.829 -11.365 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.6 m -58.84 -43.08 90.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.961 -154.757 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -61.22 -60.19 4.14 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.32 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.411 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 36.7 t -65.4 -24.12 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.45 -173.518 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.222 -166.847 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.965 0 N-CA-C 113.588 0.572 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.68 157.35 28.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.453 -169.658 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.8 t -84.08 118.07 70.32 Favored Pre-proline 0 C--O 1.25 1.106 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.166 -162.279 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -60.03 -21.88 67.06 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.625 2.217 . . . . 0.0 113.106 170.051 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.48 -74.3 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.343 -176.647 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.37 -20.82 19.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.665 -165.111 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.8 t0 72.24 56.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.453 -171.463 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -116.45 -167.86 1.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.999 160.879 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.49 149.35 26.28 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.259 163.274 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -110.2 111.2 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.636 -164.785 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -78.81 163.73 25.1 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.318 179.831 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -60.52 -63.53 1.27 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.724 -159.48 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.19 -10.95 60.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.785 -174.534 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.6 44.3 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.238 170.657 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.55 141.44 47.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.607 -177.742 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.568 HG21 HD22 ' A' ' 28' ' ' LEU . 11.5 m -136.8 117.47 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.283 151.596 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -88.82 133.07 34.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.249 -175.936 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.7 121.37 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.435 -159.661 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HG3' ' A' ' 44' ' ' GLU . 5.5 mp 59.87 27.12 16.41 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.8 166.787 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.03 19.17 29.44 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 162.609 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -171.09 154.57 4.12 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 164.694 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.7 OUTLIER -80.15 176.68 9.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.261 -163.562 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.1 m95 -151.86 -176.12 5.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.353 -176.812 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -100.75 146.7 26.91 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.479 171.489 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.8 tpp85 -63.53 -47.31 83.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.831 -169.524 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -62.95 -31.45 77.07 Favored 'Trans proline' 0 N--CA 1.483 0.912 0 C-N-CA 122.525 2.15 . . . . 0.0 113.612 175.661 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -70.1 -43.94 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.188 -165.909 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.568 HD22 HG21 ' A' ' 16' ' ' VAL . 5.5 tp -69.04 77.59 0.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.27 -164.253 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 4.7 mtmt -137.44 149.65 47.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.412 -166.284 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -69.76 127.55 33.33 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.45 -178.517 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.65 18.35 20.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.712 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 55' ' ' CYS . 19.4 mmmt -101.3 -60.16 1.57 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.356 162.215 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.3 p -103.65 -35.9 8.09 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 -167.538 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 90.28 49.73 3.18 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 179.149 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.775 ' HE3' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -105.25 142.0 35.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.389 160.817 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.488 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 90.4 m -69.08 151.96 45.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.262 167.059 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.775 HD23 ' HE3' ' A' ' 35' ' ' LYS . 19.1 mt -116.94 156.92 26.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.26 -169.535 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -104.28 -168.21 1.46 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.627 -173.375 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.0 p -60.85 -26.38 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.547 -166.121 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.22 65.98 0.12 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -172.982 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.78 16.61 2.41 Favored Glycine 0 CA--C 1.521 0.443 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 168.506 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.716 ' HB2' HD13 ' A' ' 37' ' ' LEU . 10.3 p80 -111.93 -169.35 1.45 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.632 -177.286 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.413 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -144.24 -164.0 1.8 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.557 165.364 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -167.05 157.27 11.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.307 163.062 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.527 ' CE1' ' HH ' ' A' ' 50' ' ' TYR . 33.6 p80 -134.08 123.34 24.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.321 162.854 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 58.32 37.68 25.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.906 -178.841 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.09 23.15 69.51 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 165.859 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.64 99.95 25.92 Favored Pre-proline 0 C--O 1.244 0.784 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 168.672 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.8 Cg_endo -67.69 168.28 18.83 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.524 2.149 . . . . 0.0 113.614 -172.385 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HH ' ' CE1' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -152.98 -165.04 2.08 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.075 166.252 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.1 m -56.85 131.12 48.53 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.141 -1.39 . . . . 0.0 110.258 161.826 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -33.08 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.845 160.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.532 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 62.8 m80 -156.66 163.68 24.18 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.23 163.591 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.85 -17.63 18.09 Favored 'Cis proline' 0 N--CA 1.481 0.757 0 C-N-CA 122.705 -1.79 . . . . 0.0 113.631 -12.019 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.3 m -59.35 -44.03 92.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.796 -155.778 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.98 -54.39 45.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.467 178.161 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.532 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -72.7 -35.24 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.323 -169.296 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.36 -177.086 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.522 ' HD2' ' HD3' ' A' ' 21' ' ' LYS . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.076 0 N-CA-C 113.486 0.533 . . . . 0.0 113.486 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -126.22 159.61 32.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.409 -171.225 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -86.08 119.27 71.62 Favored Pre-proline 0 C--O 1.249 1.046 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.199 -167.228 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -59.4 -23.75 71.67 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.655 2.237 . . . . 0.0 113.19 169.552 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -73.21 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.409 -178.53 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -97.69 -21.59 16.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.712 -161.887 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 73.42 67.18 0.1 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.559 -170.404 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.13 -171.19 2.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.102 159.618 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -102.22 154.94 18.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.757 166.232 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.907 HG22 ' NE2' ' A' ' 24' ' ' HIS . 59.1 t -124.19 112.03 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.828 -160.845 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.484 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.3 t80 -73.83 164.79 26.17 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.376 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -60.74 -56.93 15.32 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.798 -160.477 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.93 59.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.438 -1.255 . . . . 0.0 111.621 -174.311 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.646 ' O ' HG13 ' A' ' 10' ' ' VAL . 6.3 pt-20 -111.2 37.81 2.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.965 163.921 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.806 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -119.33 131.23 55.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.039 164.135 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.425 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 29.1 m -109.58 178.51 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.525 156.718 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.67 142.61 51.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.662 -176.461 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.423 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.6 t -177.77 136.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.376 170.545 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.08 29.12 18.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.593 -173.481 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.41 18.15 73.19 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 168.259 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HD3' ' HD2' ' A' ' 1' ' ' PRO . 9.0 mmtp -142.86 150.97 40.57 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 164.52 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 1.1 m-20 -81.3 178.33 8.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.314 -164.102 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.3 m95 -151.08 160.18 44.05 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.4 -179.347 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.907 ' NE2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -78.19 136.21 37.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.365 166.27 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.79 -43.86 93.19 Favored Pre-proline 0 CA--C 1.545 0.763 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.786 -170.87 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.0 Cg_endo -64.07 -23.79 67.04 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.351 2.034 . . . . 0.0 113.604 175.71 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.38 -45.62 21.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.313 -173.086 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.562 HD23 ' HB2' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -73.23 91.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.907 . . . . 0.0 110.346 -170.19 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.566 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 5.1 mtmt -152.6 141.56 21.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.385 -167.591 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -61.79 126.26 26.73 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.471 171.14 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.56 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 13.4 tp10 -97.21 20.32 11.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 170.942 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -107.36 -62.34 1.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.189 165.86 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.6 p -102.46 -19.17 15.02 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.776 -168.39 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.39 34.92 30.96 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.306 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -88.83 126.9 35.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.307 169.524 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.566 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 94.4 m -60.91 135.6 57.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.211 163.831 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 42' ' ' HIS . 81.2 mt -99.49 104.43 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.387 -163.528 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -111.1 -168.63 1.33 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.395 -169.123 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 40.5 t 58.63 -89.02 0.02 OUTLIER 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.731 162.261 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.96 47.32 0.07 OUTLIER Glycine 0 CA--C 1.529 0.931 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 159.35 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -116.28 20.2 12.72 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -163.175 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.652 ' HB3' HD22 ' A' ' 37' ' ' LEU . 38.2 p-80 -101.4 -169.57 1.71 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.916 -0.642 . . . . 0.0 110.711 177.011 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -175.41 159.51 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.14 167.803 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.446 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -117.62 137.45 52.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.068 -162.495 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -117.81 116.12 26.36 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 158.75 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 1.4 mt-10 60.74 -148.04 0.44 Allowed 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.439 -151.343 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.56 36.36 3.86 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 165.686 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -109.55 88.33 6.19 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-O 121.241 0.544 . . . . 0.0 109.786 171.757 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.3 Cg_endo -65.89 154.2 74.93 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.493 2.128 . . . . 0.0 113.58 -176.496 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 7.8 m-85 -148.16 -165.81 2.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.795 164.886 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 80.5 m -59.22 135.82 57.76 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.938 161.992 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -60.33 -34.72 74.22 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.254 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.9 m-70 -156.09 172.85 5.52 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.313 164.162 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.0 Cg_endo -63.35 -18.02 5.2 Favored 'Cis proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.431 -2.32 . . . . 0.0 112.533 -22.263 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.8 m -57.19 -45.2 83.93 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.221 -154.644 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -60.88 -49.03 79.11 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.317 -174.328 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.413 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -68.84 -42.24 77.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.495 178.145 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 -170.216 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.72 150.77 51.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.391 -168.958 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.4 t -84.47 117.6 69.11 Favored Pre-proline 0 C--O 1.25 1.127 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.253 -164.201 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.16 -20.08 66.33 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 C-N-CA 122.784 2.322 . . . . 0.0 113.254 170.056 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.501 ' HG3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -78.97 -73.48 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.464 -177.543 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.61 -21.98 18.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.527 -164.487 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 72.55 64.56 0.12 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.501 -169.061 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -125.38 -168.58 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.083 161.465 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.66 151.63 23.46 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.592 161.922 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 33.9 t -112.21 112.57 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.494 -161.296 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.78 151.43 35.98 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.251 179.381 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -60.22 -49.38 77.86 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.007 -158.398 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.3 -0.78 33.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.472 -167.487 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -104.24 4.39 33.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 174.378 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.57 152.88 33.77 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.312 -160.811 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 28' ' ' LEU . 21.7 m -150.29 136.8 12.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.754 159.116 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.9 m -113.19 135.11 54.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.505 -165.603 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.59 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 22.4 t -178.01 136.01 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.536 -165.692 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 60.14 21.64 10.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.593 -174.42 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 16.89 79.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 169.407 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 158.84 43.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 163.15 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.06 176.84 7.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.249 -164.816 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 30.9 m95 -150.13 179.94 7.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 113.983 -1.462 . . . . 0.0 109.227 -179.275 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 41.8 m80 -96.03 150.88 19.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.425 166.559 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.583 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -61.48 -58.91 15.42 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.875 178.336 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 13.3 Cg_endo -54.28 -22.79 27.62 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 122.188 1.925 . . . . 0.0 113.619 -177.426 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.501 ' HB3' ' HG3' ' A' ' 5' ' ' LYS . 8.0 m -81.45 -53.97 5.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.382 -172.247 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.917 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -63.71 93.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.482 -161.843 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -142.49 146.67 34.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.408 -176.79 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -60.09 126.51 27.82 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.541 174.287 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.499 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 1.2 tt0 -94.75 27.7 2.97 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.104 172.116 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -124.19 -55.8 1.66 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.468 173.668 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.9 p -107.4 -21.8 12.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.832 -172.546 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.96 51.42 23.97 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -171.348 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 tptm -98.05 123.47 42.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.14 163.566 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.4 m -61.43 133.46 55.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.118 170.096 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.455 HD13 ' HB2' ' A' ' 42' ' ' HIS . 94.8 mt -98.2 138.03 36.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.426 -161.733 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 40' ' ' GLY . 68.7 m -60.42 150.28 31.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.268 165.406 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.0 t -64.84 65.9 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.63 162.204 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 38' ' ' THR . . . 138.69 150.04 5.54 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.527 -164.536 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.82 14.74 82.05 Favored Glycine 0 C--N 1.344 0.986 0 C-N-CA 119.934 -1.127 . . . . 0.0 111.37 171.926 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.917 ' CE1' HD21 ' A' ' 28' ' ' LEU . 51.9 p-80 -120.11 -167.03 1.37 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 113.993 -1.104 . . . . 0.0 110.809 175.141 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -156.66 -165.63 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.899 -173.442 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.4 172.76 5.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.99 164.206 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.474 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 34.4 p80 -130.83 104.73 7.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.353 162.406 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 58.45 42.8 20.56 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.884 177.023 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 110.67 -18.91 26.65 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 166.948 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -98.73 101.11 11.01 Favored Pre-proline 0 C--O 1.243 0.752 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 -170.934 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 10.6 Cg_endo -65.82 157.99 56.08 Favored 'Trans proline' 0 N--CA 1.487 1.109 0 C-N-CA 122.472 2.115 . . . . 0.0 113.533 -171.059 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 62.8 m-85 -152.45 -176.75 5.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.052 169.964 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 71.3 m -57.42 134.2 55.83 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.029 158.908 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 5.8 t30 -69.47 -29.5 67.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.761 160.699 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.9 m-70 -153.59 161.03 30.21 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.153 164.546 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 10.0 Cg_endo -73.62 -16.79 18.45 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 122.685 -1.798 . . . . 0.0 113.675 -12.516 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -59.4 -53.45 58.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.752 -156.161 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -61.03 -48.1 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.5 178.762 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.1 p -65.53 -21.21 66.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.33 -176.762 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.16 -168.661 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.587 ' H2 ' ' HD3' ' A' ' 2' ' ' LYS . 5.4 Cg_exo . . . . . 0 N--CA 1.485 0.991 0 N-CA-C 113.503 0.54 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.587 ' HD3' ' H2 ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -135.09 132.26 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.414 -175.191 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.9 t -80.68 121.69 81.44 Favored Pre-proline 0 C--O 1.251 1.134 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.029 -162.66 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -63.43 -27.13 70.63 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 C-N-CA 122.957 2.438 . . . . 0.0 113.311 174.256 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -73.3 0.25 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.288 -179.178 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.5 p -91.95 -22.86 19.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.748 -160.998 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.6 t0 72.39 67.74 0.13 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.482 -169.809 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.0 OUTLIER -127.17 -168.77 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.156 162.155 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 152.93 22.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.601 162.254 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 74.9 t -122.04 110.46 27.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.945 -163.765 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -73.32 162.54 29.23 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.423 -178.666 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.486 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.7 OUTLIER -60.97 -55.73 29.52 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.822 -161.594 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.48 -9.25 59.57 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.579 -174.195 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.536 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 2.2 mt-10 -112.49 35.79 3.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.129 163.38 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.799 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -119.08 136.39 54.17 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.097 165.253 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.696 HG21 HD22 ' A' ' 28' ' ' LEU . 16.1 m -123.76 135.56 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.514 156.42 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 3.4 m -103.57 138.43 40.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.485 -170.685 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.491 ' C ' HD22 ' A' ' 19' ' ' LEU . 5.1 t -170.39 131.39 0.94 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.383 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.643 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.99 17.58 6.79 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.571 -173.355 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.81 -25.37 22.82 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 165.35 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 148.52 43.62 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.773 -0.714 . . . . 0.0 110.232 -178.27 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -81.78 177.6 8.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.17 -164.071 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.9 m95 -151.09 163.81 37.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.048 -1.433 . . . . 0.0 109.377 -177.147 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -84.6 140.11 31.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.593 170.426 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.537 ' CG ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.26 -44.21 92.55 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.961 -167.524 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD3' ' CG ' ' A' ' 25' ' ' ARG . 9.1 Cg_exo -51.96 -47.73 25.11 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.752 2.301 . . . . 0.0 113.424 166.446 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 m -63.95 -46.01 86.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.467 -165.717 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.95 HD21 ' CE1' ' A' ' 42' ' ' HIS . 1.6 tp -62.4 92.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -169.993 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.586 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 9.7 mtpm? -143.3 140.08 30.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.392 -170.111 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 10.7 t -60.23 129.11 40.07 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.448 171.363 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -98.81 39.78 1.24 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.095 -1.412 . . . . 0.0 110.242 172.458 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -143.23 -43.8 0.29 Allowed 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.362 -175.674 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.2 p -115.25 -19.05 10.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.006 173.685 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.84 41.78 54.9 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 179.41 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.402 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.86 133.56 44.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.315 169.667 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.2 m -60.74 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.299 168.461 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.865 HD13 ' HB2' ' A' ' 42' ' ' HIS . 96.5 mt -97.9 132.62 43.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.308 -164.82 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -106.03 -168.67 1.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.524 -166.246 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.6 t -60.91 89.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.433 -165.067 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.57 55.45 20.34 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 163.825 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.5 21.55 2.73 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 164.537 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.95 ' CE1' HD21 ' A' ' 28' ' ' LEU . 46.3 p-80 -115.17 -166.9 1.16 Allowed 'General case' 0 CA--C 1.524 -0.057 0 CA-C-N 114.92 -0.64 . . . . 0.0 110.581 -176.747 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.41 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -161.4 -164.46 1.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.706 -169.452 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.4 148.89 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.177 163.065 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.503 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 9.1 p80 -91.13 165.35 13.54 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.458 157.051 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.68 87.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.1 -167.832 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 145.16 -61.5 0.49 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.581 -1.007 . . . . 0.0 110.581 -169.149 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -135.33 142.34 41.13 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-O 121.693 0.758 . . . . 0.0 109.78 -162.108 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.586 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 13.6 Cg_endo -72.42 158.31 51.56 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.865 2.377 . . . . 0.0 113.757 173.697 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 34.2 m-85 -147.0 178.01 8.69 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.946 168.74 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -56.44 140.44 45.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.474 163.25 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -60.66 -34.26 74.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.111 165.202 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 48.6 m80 -162.63 166.42 13.73 Favored Pre-proline 0 CA--C 1.552 1.019 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.331 165.556 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -71.91 -13.15 16.54 Favored 'Cis proline' 0 C--N 1.353 0.774 0 C-N-CA 122.745 -1.773 . . . . 0.0 113.569 -12.7 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.8 m -59.82 -41.26 90.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.68 -157.286 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -61.06 -38.2 85.36 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.367 176.856 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.1 t -75.77 -18.19 59.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.464 176.503 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.143 -168.79 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.461 ' CD ' ' HE2' ' A' ' 21' ' ' LYS . 5.6 Cg_endo . . . . . 0 N--CA 1.486 1.03 0 N-CA-C 113.562 0.562 . . . . 0.0 113.562 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 28.9 mttp -133.53 156.63 47.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.455 170.591 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.3 t -86.1 123.28 72.0 Favored Pre-proline 0 C--O 1.25 1.128 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.167 -164.355 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.619 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -62.65 -30.31 78.68 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.808 2.338 . . . . 0.0 113.164 169.424 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -69.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.495 -175.313 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -98.33 -22.58 16.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 -165.178 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.9 59.68 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.52 -171.543 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.458 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -124.59 -172.06 2.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.142 159.2 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -100.76 153.1 19.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.7 168.803 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -118.12 113.46 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.74 -164.261 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.545 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 34.9 p90 -82.17 163.88 21.64 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.359 -178.095 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.541 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 m-85 -58.12 -59.5 5.2 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.26 -153.288 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.35 -11.24 59.81 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.698 -174.615 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.677 ' O ' HG13 ' A' ' 10' ' ' VAL . 14.4 mt-10 -108.2 46.2 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.807 164.32 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' HD2' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -118.59 141.34 48.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.699 161.91 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -136.81 131.52 47.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.712 157.695 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 34.3 m -97.98 144.19 27.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.481 -164.531 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.8 t -171.39 130.11 0.72 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.43 -171.035 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.17 15.08 4.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.698 -168.577 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.19 -24.58 31.57 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 170.661 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.461 ' HE2' ' CD ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -110.98 140.31 45.6 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 114.806 -0.697 . . . . 0.0 110.091 -178.897 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 5.6 m-20 -77.77 177.92 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.212 -161.299 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.619 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 31.7 m95 -150.59 171.15 17.56 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 113.82 -1.536 . . . . 0.0 109.279 179.739 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.4 m80 -88.75 149.14 23.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.506 174.925 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 tpp180 -61.32 -45.73 95.01 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.876 -170.975 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -64.24 -34.89 54.54 Favored 'Trans proline' 0 N--CA 1.484 0.956 0 C-N-CA 122.582 2.188 . . . . 0.0 113.601 174.378 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.31 -47.4 61.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.216 -164.926 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.086 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.5 tp -61.72 83.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.296 -168.444 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -144.88 152.0 39.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.442 -165.567 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -70.05 138.67 52.3 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.459 -177.777 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG3' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -89.65 -23.31 21.93 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.735 174.555 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -71.08 -64.63 0.87 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.957 172.81 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.1 p -108.47 -19.79 13.33 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.965 -159.493 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.73 42.82 53.1 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 177.627 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -100.19 136.52 39.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.346 166.3 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 m -60.69 146.19 46.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.323 170.891 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 96.5 mt -110.38 153.05 25.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.288 -163.231 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 39' ' ' SER . 14.5 m -105.83 170.29 7.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.452 -163.569 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.581 ' H ' HG22 ' A' ' 38' ' ' THR . 4.5 t -61.64 -17.67 56.31 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.459 -168.344 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.91 57.19 0.14 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.97 11.61 3.63 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 114.917 -0.642 . . . . 0.0 111.753 166.889 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 1.086 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.6 p-80 -111.11 -169.8 1.52 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.144 0.497 . . . . 0.0 111.007 -177.662 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.41 ' N ' ' CD2' ' A' ' 42' ' ' HIS . . . -154.24 -165.14 2.01 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.871 167.949 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.508 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.84 158.41 4.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.126 171.516 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.422 ' N ' ' HG2' ' A' ' 44' ' ' GLU . 10.1 p80 -123.2 172.76 8.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.957 157.947 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -61.42 91.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.192 -163.906 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.65 -65.77 0.34 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -169.181 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HD2' ' CE2' ' A' ' 50' ' ' TYR . 2.6 pttp -152.89 138.98 12.07 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-O 121.91 0.862 . . . . 0.0 109.961 -163.501 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.594 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 20.5 Cg_endo -69.28 170.01 16.98 Favored 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.934 2.422 . . . . 0.0 113.572 170.127 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -153.64 -164.99 2.02 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.908 162.859 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 89.0 m -57.19 136.82 56.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.259 159.973 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -31.93 71.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.938 163.606 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.511 ' CD2' ' HB3' ' A' ' 57' ' ' SER . 49.0 m80 -161.51 165.99 15.62 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.305 165.466 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -72.03 -14.25 16.56 Favored 'Cis proline' 0 N--CA 1.482 0.8 0 C-N-CA 122.557 -1.851 . . . . 0.0 113.582 -13.934 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.0 m -59.81 -42.3 93.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.682 -157.11 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -61.0 -39.25 88.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.53 176.083 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 15.9 t -84.54 -12.42 54.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -173.901 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.32 175.906 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.407 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 141.02 46.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.388 -168.734 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.9 t -82.25 117.02 66.92 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.164 -163.917 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.83 -21.92 72.06 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.727 2.285 . . . . 0.0 113.216 170.049 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? -76.42 -71.1 0.41 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.482 -175.836 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.64 -22.72 16.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.582 -164.991 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.47 55.49 0.15 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.503 -171.38 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.479 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -117.5 -169.25 1.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.948 159.771 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.94 148.43 25.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.65 167.096 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.7 t -109.7 111.09 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.651 -167.053 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 34.7 t80 -74.79 159.03 32.47 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.306 178.01 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.463 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 6.7 m-85 -60.58 -62.38 1.9 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.75 -160.118 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -1.72 11.63 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.72 -173.752 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -102.27 14.06 32.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.379 178.625 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -96.6 151.41 19.63 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.33 -161.496 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.522 HG21 HD22 ' A' ' 28' ' ' LEU . 16.0 m -143.9 145.02 22.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.601 156.19 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.1 m -115.71 136.26 53.23 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.715 -166.965 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 t -178.43 128.69 0.12 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.195 -169.316 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.12 34.97 21.23 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.605 -172.479 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.46 18.13 60.68 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 168.119 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -141.4 155.3 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 165.284 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -90.95 176.58 6.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.403 -165.822 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.583 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 26.2 m95 -149.8 -177.88 6.14 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.24 -177.079 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -99.2 145.97 26.66 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.553 168.928 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.1 mtp180 -61.22 -48.65 91.05 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.726 -168.899 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -64.0 -34.8 57.68 Favored 'Trans proline' 0 N--CA 1.483 0.87 0 C-N-CA 122.492 2.128 . . . . 0.0 113.647 177.049 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.01 -45.39 89.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.338 -166.131 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.838 HD21 ' CE1' ' A' ' 42' ' ' HIS . 9.6 tp -60.41 93.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.316 -162.173 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 2.2 mttt -141.02 153.58 45.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.331 -164.268 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -73.35 126.4 30.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.403 173.27 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 19.3 mt-10 -96.09 33.46 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.046 168.509 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -128.05 -52.8 1.31 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.077 175.619 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.21 -18.81 13.21 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.018 -177.462 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.12 36.42 40.63 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.384 -1.086 . . . . 0.0 110.384 175.762 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -100.39 137.0 39.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.476 170.38 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 23.3 m -66.96 147.96 52.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.433 170.315 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.766 HD13 ' CB ' ' A' ' 42' ' ' HIS . 6.9 mt -113.08 154.25 26.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.269 -169.939 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.2 m -154.28 158.24 39.9 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.128 -160.597 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m 60.59 11.96 3.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.122 171.519 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 59.19 54.45 37.81 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.201 -1.159 . . . . 0.0 110.201 -159.406 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.82 6.61 83.5 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 114.634 -0.783 . . . . 0.0 111.959 177.675 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.838 ' CE1' HD21 ' A' ' 28' ' ' LEU . 15.4 p-80 -107.07 -172.18 2.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.38 -166.195 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.88 -163.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.813 163.897 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.8 tt0 -147.86 133.85 19.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.258 176.497 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.14 125.28 26.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 162.936 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.27 -150.19 0.42 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 -152.753 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -96.0 32.46 6.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 166.993 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -117.84 99.16 52.1 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-O 121.702 0.763 . . . . 0.0 109.799 170.724 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.0 Cg_endo -58.81 165.34 8.36 Favored 'Trans proline' 0 N--CA 1.486 1.04 0 C-N-CA 122.161 1.907 . . . . 0.0 113.649 173.302 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.517 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -153.73 -165.46 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.072 171.311 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 72.4 m -57.45 133.21 55.0 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.351 162.543 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -60.7 -31.01 70.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.926 161.469 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.57 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 48.9 m80 -159.4 162.24 25.94 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.115 163.858 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -74.28 -17.42 18.95 Favored 'Cis proline' 0 N--CA 1.482 0.805 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.552 -14.093 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.19 -37.05 76.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.796 -155.311 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -62.49 -60.63 3.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.384 172.079 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.57 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 1.6 m -71.74 -17.19 62.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.414 -166.2 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.334 171.651 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.486 1.064 0 N-CA-C 113.554 0.559 . . . . 0.0 113.554 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.515 ' HG2' ' NZ ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -144.36 144.31 31.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.375 169.635 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -87.79 118.89 70.28 Favored Pre-proline 0 C--O 1.251 1.136 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.135 -164.56 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -60.97 -27.15 84.35 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.712 2.275 . . . . 0.0 113.211 169.108 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -69.78 0.36 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.459 -173.986 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -96.59 -22.07 17.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.621 -166.922 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.05 53.73 0.19 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.45 -171.238 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 -167.91 1.25 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.001 160.674 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.48 149.09 26.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.269 162.803 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 52.0 t -109.62 111.15 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.667 -166.502 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.485 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.6 t80 -78.84 161.76 26.54 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.282 178.117 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.68 -62.64 1.73 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.966 -157.723 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -10.83 60.16 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.779 -173.681 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.8 pt-20 -103.04 43.09 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.189 171.15 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -111.84 147.31 36.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.548 -177.45 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -140.43 143.15 29.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.459 154.188 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.9 m -115.61 133.82 55.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.616 -166.617 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.475 ' OG ' HD22 ' A' ' 19' ' ' LEU . 17.1 t -178.3 136.68 0.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.333 -171.4 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.97 29.43 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.65 -172.992 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.23 17.33 70.06 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 167.824 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' NZ ' ' HG2' ' A' ' 2' ' ' LYS . 1.2 tttm -143.64 160.13 41.22 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 164.256 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.02 177.34 6.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.306 -165.686 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 27.6 m95 -151.94 -174.94 5.03 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.116 -178.84 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.8 m80 -101.4 146.99 26.87 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.543 169.546 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.572 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 51.1 ttp180 -60.98 -47.14 96.35 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.727 -168.75 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -63.43 -35.36 61.47 Favored 'Trans proline' 0 N--CA 1.484 0.936 0 C-N-CA 122.55 2.166 . . . . 0.0 113.576 175.483 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -67.1 -50.81 60.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.328 -163.236 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.429 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.3 tp -60.37 89.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.339 -163.674 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.3 ttmm -147.57 141.96 26.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.321 -164.95 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.5 t -60.83 119.71 8.73 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.283 165.627 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -96.91 27.2 4.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.962 168.02 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.73 -55.71 2.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.092 169.165 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.3 p -106.96 -24.52 11.98 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.652 -174.351 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.79 45.3 7.3 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -177.436 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.24 124.87 46.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.304 168.137 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 m -61.0 139.48 58.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.269 168.109 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 75.0 mt -103.39 127.03 50.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.273 -165.371 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -69.57 -170.21 0.28 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.565 169.603 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -105.14 18.15 22.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.6 -168.474 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.696 ' H ' HG23 ' A' ' 38' ' ' THR . . . -178.62 58.71 0.09 OUTLIER Glycine 0 CA--C 1.531 1.048 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 162.334 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.25 10.98 1.56 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.88 168.446 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 14.6 p80 -113.4 -169.09 1.43 Allowed 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.415 -0.392 . . . . 0.0 110.868 -175.913 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -154.08 -164.17 1.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.909 168.201 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.3 pp20? -164.08 139.52 6.11 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.085 170.638 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.421 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 57.0 t60 -95.3 161.99 13.86 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.3 159.951 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 28.6 mm-40 -61.44 88.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.049 -166.364 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.18 -66.0 0.35 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.304 -1.119 . . . . 0.0 110.304 -167.059 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.14 141.91 19.09 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.422 0.63 . . . . 0.0 109.82 -163.445 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.54 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.7 Cg_endo -68.44 160.05 50.82 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.967 2.445 . . . . 0.0 113.734 169.552 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 60.8 m-85 -147.63 -163.35 1.75 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.568 164.426 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.2 m -56.94 138.36 54.13 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.265 159.078 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -60.73 -35.84 77.37 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.988 164.113 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.677 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 64.8 m80 -157.85 165.14 19.3 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.227 164.423 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -73.07 -15.36 18.1 Favored 'Cis proline' 0 C--N 1.354 0.868 0 C-N-CA 122.512 -1.87 . . . . 0.0 113.595 -14.192 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.8 m -59.61 -39.42 84.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.619 -156.636 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -61.15 -56.99 14.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.351 171.919 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.677 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -65.66 -26.52 67.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.399 -169.418 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.321 -169.896 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.443 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 12.1 Cg_endo . . . . . 0 N--CA 1.486 1.044 0 N-CA-C 113.617 0.583 . . . . 0.0 113.617 . . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.442 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -143.9 152.83 41.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.461 -167.063 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -89.99 118.01 68.55 Favored Pre-proline 0 C--O 1.249 1.043 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.177 -165.657 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -57.89 -26.82 76.05 Favored 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.61 2.207 . . . . 0.0 113.175 168.933 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -74.45 -73.41 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.417 -174.885 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -93.87 -21.8 19.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 -165.683 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 t0 72.59 58.63 0.13 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.526 -172.601 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' NZ ' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -119.74 -168.96 1.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.027 159.452 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 3.7 mt-10 -102.71 154.03 19.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.696 162.851 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 37.1 t -113.5 114.06 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.452 -162.85 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.62 154.79 41.51 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.365 177.125 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.65 -62.24 2.0 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.847 -159.934 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.44 -1.22 10.12 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.648 -173.399 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -102.57 14.09 32.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.466 178.315 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 153.27 17.97 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 -160.815 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.804 HG21 HD22 ' A' ' 28' ' ' LEU . 15.1 m -145.11 151.15 15.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.699 155.703 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -115.41 136.23 53.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.724 -168.726 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.635 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 23.1 t -177.84 135.75 0.18 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.279 -177.923 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.3 mm? 60.04 28.41 17.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -169.844 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.27 18.21 64.86 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 170.22 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.558 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -138.05 153.85 49.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 164.893 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -87.87 176.35 7.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.412 -165.973 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.4 m95 -147.52 -177.99 6.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.134 -176.907 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.3 m80 -100.96 141.36 33.96 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.965 -1.471 . . . . 0.0 110.526 167.691 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.35 84.97 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.827 -168.251 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.562 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -58.5 -35.65 98.4 Favored 'Trans proline' 0 N--CA 1.483 0.905 0 C-N-CA 122.608 2.205 . . . . 0.0 113.538 174.78 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.91 -43.5 98.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.114 -168.832 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.912 HD11 ' CE1' ' A' ' 42' ' ' HIS . 11.9 tp -63.29 86.62 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.455 -160.442 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -131.51 148.74 52.66 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.247 -167.982 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -75.22 129.41 37.42 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.345 172.322 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -98.05 41.87 1.11 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.163 166.581 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -143.55 -40.79 0.3 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.466 -176.949 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.06 -12.61 9.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.332 173.579 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.9 42.45 99.65 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -124.24 136.89 54.49 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 164.332 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 29' ' ' LYS . 2.7 t -61.37 -170.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.242 -169.142 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.655 HD13 ' CB ' ' A' ' 42' ' ' HIS . 12.0 mt -143.1 150.96 40.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.478 -163.671 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -83.05 -171.99 3.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.294 -164.019 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 38' ' ' THR . 97.6 p -64.39 77.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.323 166.12 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 53.96 9.42 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 178.642 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.59 12.93 10.96 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.469 -0.653 . . . . 0.0 111.469 165.791 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.912 ' CE1' HD11 ' A' ' 28' ' ' LEU . 24.7 p-80 -102.56 -168.79 1.57 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.579 -0.81 . . . . 0.0 110.528 175.933 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.18 158.62 14.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.889 161.304 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.459 ' HB2' ' HH2' ' A' ' 23' ' ' TRP . 2.2 tm-20 -113.13 127.3 56.16 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.982 -163.2 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.533 ' NE2' ' HG3' ' A' ' 46' ' ' GLU . 86.3 t60 -121.48 130.24 53.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.675 160.279 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.533 ' HG3' ' NE2' ' A' ' 45' ' ' HIS . 3.2 mm-40 58.27 34.73 24.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.074 171.698 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 36.65 70.65 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 171.642 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.06 128.2 9.18 Favored Pre-proline 0 C--O 1.242 0.667 0 CA-C-O 121.655 0.741 . . . . 0.0 109.612 162.358 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HB3' ' CD2' ' A' ' 42' ' ' HIS . 14.6 Cg_endo -63.59 159.9 38.65 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 C-N-CA 122.567 2.178 . . . . 0.0 113.57 174.45 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 72.9 m-85 -151.47 -174.11 4.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.758 165.761 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.8 m -57.63 123.56 16.04 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 113.569 -1.65 . . . . 0.0 110.229 164.362 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -60.73 -28.65 68.84 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.11 -1.404 . . . . 0.0 109.931 165.095 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.456 ' CD2' ' CB ' ' A' ' 57' ' ' SER . 56.7 m80 -155.89 160.27 30.93 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.862 -1.063 . . . . 0.0 108.982 159.255 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -74.57 -20.24 16.26 Favored 'Cis proline' 0 C--N 1.354 0.839 0 C-N-CA 122.803 -1.749 . . . . 0.0 113.699 -11.994 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.599 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 81.9 m -58.91 -56.1 26.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.808 -155.449 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.442 ' CE1' ' HB2' ' A' ' 45' ' ' HIS . 7.0 t80 -61.06 -45.33 95.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.293 -179.772 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.456 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 17.2 t -61.02 -15.4 31.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.547 175.407 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.184 -173.21 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.429 0.511 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.49 133.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.439 169.24 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.7 t -89.58 133.04 35.21 Favored Pre-proline 0 C--O 1.243 0.753 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.166 -165.36 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 6.3 Cg_exo -73.06 -26.78 14.67 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.246 2.631 . . . . 0.0 113.44 171.533 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 -64.41 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.297 -164.712 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -92.5 -28.9 16.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.371 -164.792 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 73.72 58.79 0.09 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.525 -165.832 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.83 -168.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.838 158.245 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -108.82 149.57 28.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.624 160.772 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.935 HG22 ' CD2' ' A' ' 24' ' ' HIS . 65.5 t -103.5 117.89 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.595 -167.662 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -91.88 55.12 2.59 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.951 -156.072 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 61.59 -79.09 0.02 OUTLIER 'General case' 0 C--N 1.34 0.155 0 CA-C-N 113.976 -1.466 . . . . 0.0 110.358 178.477 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.18 -2.12 36.11 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.512 -163.068 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.69 13.96 30.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.251 176.682 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -83.78 153.48 24.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.258 -164.974 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.601 ' CG2' HD22 ' A' ' 28' ' ' LEU . 17.2 m -148.26 122.18 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.741 157.362 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 88.4 m -98.59 135.81 39.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.408 -162.197 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.455 ' OG ' HD22 ' A' ' 19' ' ' LEU . 21.8 t -178.0 137.39 0.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.586 -167.594 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.23 25.92 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.548 -173.039 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.58 -24.2 24.42 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 165.868 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -127.33 139.72 52.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 114.703 -0.749 . . . . 0.0 110.029 -177.251 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -68.86 -179.17 1.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.338 -161.394 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 60.3 m95 -145.77 -177.6 5.67 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 113.59 -1.641 . . . . 0.0 109.396 178.659 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.935 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -100.49 143.73 30.32 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.616 168.83 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 21.7 ttp85 -63.57 -53.22 53.28 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.81 179.13 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.7 Cg_endo -53.25 -13.41 3.22 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 122.459 2.106 . . . . 0.0 113.612 172.296 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -96.38 -64.26 1.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.328 -179.171 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.648 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.8 OUTLIER -64.85 91.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.398 -166.418 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.85 170.68 17.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.234 168.638 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.5 t -60.79 150.62 32.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.326 168.373 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.9 mm-40 -118.74 25.7 10.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.732 160.063 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.47 -59.99 1.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.172 167.902 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -102.3 -48.44 4.19 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.645 -167.759 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.42 56.45 0.51 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 167.284 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -131.01 137.52 49.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.39 167.386 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.4 m -60.73 153.16 24.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.442 174.02 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.5 mt -113.54 153.38 28.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.404 -165.424 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.477 HG22 ' N ' ' A' ' 39' ' ' SER . 93.8 m -68.72 166.58 17.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.475 -178.025 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.477 ' N ' HG22 ' A' ' 38' ' ' THR . 66.4 m -62.4 77.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.415 170.175 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.3 55.2 3.53 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 172.291 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.36 11.53 4.98 Favored Glycine 0 CA--C 1.522 0.519 0 CA-C-N 115.102 -0.549 . . . . 0.0 111.777 166.172 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.648 ' CE1' HD11 ' A' ' 28' ' ' LEU . 3.9 p80 -99.45 -169.26 1.73 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.84 -0.68 . . . . 0.0 110.47 177.49 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -130.91 171.65 12.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.339 168.91 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -147.76 138.35 23.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.05 -170.879 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -121.61 114.79 21.67 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.437 -0.801 . . . . 0.0 108.858 164.797 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.73 -148.11 0.44 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.522 -152.408 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.45 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.35 35.0 4.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 166.923 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm -107.37 87.55 3.36 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 121.211 0.529 . . . . 0.0 109.756 169.229 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.0 Cg_endo -62.85 147.9 94.09 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 122.526 2.151 . . . . 0.0 113.552 -174.847 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.5 m-85 -144.95 -165.78 2.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.922 162.095 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 99.5 m -59.11 -178.01 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.703 171.534 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.84 -32.89 11.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.178 164.586 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.52 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.2 m-70 -164.75 165.97 11.75 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.03 -0.987 . . . . 0.0 109.541 171.472 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.52 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 Cg_endo -69.61 -6.48 9.21 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.635 -1.819 . . . . 0.0 113.604 -11.515 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.5 m -60.28 -51.05 71.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.425 -162.001 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -60.73 -37.42 81.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.416 -168.136 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 60.1 p -86.91 -21.66 26.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.515 -173.817 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.358 -170.232 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.242 0 N-CA-C 113.369 0.488 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 2.1 ttmm 63.77 162.34 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.218 165.331 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.8 t -80.6 131.27 61.6 Favored Pre-proline 0 C--O 1.243 0.737 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.486 -163.256 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.605 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.2 Cg_exo -70.4 -9.11 25.17 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 123.223 2.616 . . . . 0.0 113.504 170.328 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -102.19 -72.55 0.68 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.332 -172.38 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -91.99 -21.85 20.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.524 -160.157 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 t0 73.63 61.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.507 -167.164 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.92 166.65 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.076 159.447 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.532 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -85.4 148.72 25.87 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.42 171.92 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -110.16 116.85 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.742 -160.341 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -168.39 1.17 Allowed 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -74.28 -84.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.509 -165.973 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.78 -10.39 58.2 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.193 -0.603 . . . . 0.0 111.713 -159.158 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -104.98 42.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.963 169.621 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.35 149.12 25.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.396 176.324 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.838 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -148.85 144.71 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.065 162.05 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 m -114.99 135.85 53.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.378 -168.822 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.424 ' HB2' ' HE1' ' A' ' 42' ' ' HIS . 6.8 t -177.79 128.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.366 -168.859 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 60.17 22.11 11.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.423 -170.77 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.4 -24.4 27.6 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 164.524 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.4 137.37 51.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 114.76 -0.72 . . . . 0.0 110.24 -177.192 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.67 178.51 5.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.32 -163.388 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.605 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 41.6 m95 -146.46 177.4 9.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.59 -177.311 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -98.21 137.55 36.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.463 169.501 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 10.1 ttp85 -60.8 -47.28 96.22 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.878 -170.702 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.6 Cg_exo -54.75 -35.77 88.71 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.576 2.184 . . . . 0.0 113.544 170.929 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.34 -54.2 13.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.317 -172.967 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HG21 ' A' ' 16' ' ' VAL . 2.1 tp -62.67 96.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.322 -166.243 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -139.82 177.88 7.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 166.863 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.4 t -61.37 170.33 1.83 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.114 164.553 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.576 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 1.8 pt-20 -140.45 20.85 2.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.652 160.08 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.488 ' HE2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -100.2 -57.65 2.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.271 167.577 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.62 -49.83 4.96 Favored 'General case' 0 CA--C 1.524 -0.05 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.525 -170.895 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.05 59.73 0.61 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 169.931 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.68 139.17 27.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.058 0.456 . . . . 0.0 110.457 166.857 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.585 HG22 ' H ' ' A' ' 37' ' ' LEU . 1.8 m -61.49 171.62 1.42 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.437 -173.571 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.703 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.8 mt -129.05 -177.82 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.366 -170.858 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -109.31 -169.44 1.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.548 -170.154 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.5 t -61.32 -25.26 67.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.342 -170.059 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.513 ' H ' HG23 ' A' ' 38' ' ' THR . . . 173.37 70.52 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.79 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.57 10.7 8.53 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.615 -0.594 . . . . 0.0 111.615 166.134 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.703 ' CB ' HD13 ' A' ' 37' ' ' LEU . 22.0 p-80 -90.63 -169.5 2.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.441 173.361 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.7 172.59 12.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.328 167.632 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.543 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -128.57 147.76 50.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.964 166.758 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -84.27 -79.37 0.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.837 170.112 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -171.12 73.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.928 167.738 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 155.88 -45.75 0.52 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.545 -174.652 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 2.4 mptp? -143.98 138.61 15.2 Favored Pre-proline 0 C--O 1.242 0.665 0 CA-C-O 121.489 0.661 . . . . 0.0 109.87 -170.927 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.59 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 19.7 Cg_endo -64.18 147.15 91.33 Favored 'Trans proline' 0 N--CA 1.486 1.046 0 C-N-CA 122.658 2.238 . . . . 0.0 113.58 171.012 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.576 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 11.7 m-85 -139.49 -168.12 2.4 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.868 163.814 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 57.3 m -58.42 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.548 166.959 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -102.91 -30.26 10.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.132 161.876 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.509 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m80 -168.46 165.48 7.46 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.412 171.646 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.509 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -70.13 -5.76 9.63 Favored 'Cis proline' 0 N--CA 1.482 0.816 0 C-N-CA 122.576 -1.843 . . . . 0.0 113.741 -10.825 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.6 m -60.07 -41.33 92.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.554 -161.467 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.31 -39.59 94.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.381 -169.335 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.2 m -98.65 -19.34 17.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.328 -168.046 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.274 -167.811 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.525 ' H3 ' ' CG ' ' A' ' 22' ' ' ASP . 2.2 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 113.574 0.567 . . . . 0.0 113.574 . . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 8.4 mmtt -138.87 139.86 38.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.467 -170.38 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.1 t -97.76 122.5 54.79 Favored Pre-proline 0 C--O 1.243 0.711 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.202 -165.329 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 8.3 Cg_endo -61.78 -27.64 80.92 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 122.538 2.159 . . . . 0.0 113.024 172.1 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.521 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.75 -55.43 3.57 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.666 -155.977 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -92.03 -27.61 17.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.395 -177.488 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.95 68.29 0.1 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.504 -165.484 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 -167.69 1.86 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.017 160.394 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.425 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -110.34 149.54 30.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.114 162.419 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.5 t -108.68 130.52 61.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.813 -161.553 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.419 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.8 t80 -90.67 178.43 6.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.359 -178.832 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -64.11 -83.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.281 -167.0 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.8 -1.95 10.74 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.554 -161.872 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -102.77 18.32 21.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.21 178.843 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -98.09 146.51 25.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.276 -165.358 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 28' ' ' LEU . 14.5 m -143.3 120.92 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.891 156.515 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 33.3 m -90.31 132.29 35.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.383 -178.559 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -167.94 124.32 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.155 -162.004 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.666 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.28 24.84 14.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.574 -173.528 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 99.13 -25.43 28.25 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 161.221 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -121.77 138.54 54.33 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.848 -0.676 . . . . 0.0 109.976 178.569 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.525 ' CG ' ' H3 ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -73.06 178.6 4.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.37 -160.489 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 63.3 m95 -143.52 177.5 8.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.802 -176.377 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -102.43 139.48 37.97 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.307 168.056 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.563 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 ttt180 -61.04 -51.27 80.3 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.779 -168.242 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 10.3 Cg_endo -56.82 -28.97 79.31 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.489 2.126 . . . . 0.0 113.518 173.036 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -67.31 -64.64 0.81 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.311 177.511 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -64.57 94.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 -163.444 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.19 173.28 9.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.227 167.516 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -60.63 -178.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.187 166.259 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.531 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -135.01 18.8 3.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.736 160.45 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.6 -45.39 1.48 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.536 -168.096 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -107.12 -32.13 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.75 176.057 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.458 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 85.85 64.39 1.49 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 177.382 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.1 tttp -150.15 145.83 26.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.038 -0.581 . . . . 0.0 110.422 -178.537 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.73 153.31 43.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.461 -174.707 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.494 ' HB2' HD23 ' A' ' 28' ' ' LEU . 14.4 mt -122.06 141.12 51.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.339 -168.179 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.528 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -60.88 -175.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.442 -169.348 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 38' ' ' THR . 11.8 p -67.61 72.55 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.407 169.557 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 18' ' ' SER . . . 72.25 57.72 5.49 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 172.13 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -125.53 12.15 7.47 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 164.315 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.788 ' NE2' HD21 ' A' ' 28' ' ' LEU . 2.8 p80 -102.0 -170.31 1.8 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 114.606 -0.797 . . . . 0.0 110.411 176.104 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.81 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -126.9 -174.35 3.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.34 169.902 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.7 tm-20 -164.94 146.26 7.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.971 -168.664 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -113.73 -51.34 2.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.755 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -171.15 99.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.101 165.9 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.25 12.66 32.35 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.649 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG2' ' HG3' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -141.8 86.99 10.27 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 114.914 -0.643 . . . . 0.0 109.785 -175.632 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.494 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.1 Cg_endo -60.94 147.26 96.13 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.518 2.145 . . . . 0.0 113.608 -176.198 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 4.3 m-85 -135.51 -178.55 5.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.015 164.464 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.9 m -59.31 -178.42 0.06 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.652 172.331 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.81 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 1.1 m-20 -97.37 -34.88 10.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.999 164.481 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 33.1 m80 -154.73 173.94 4.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-O 122.135 0.969 . . . . 0.0 109.344 165.969 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.6 Cg_endo -62.29 -12.93 3.62 Favored 'Cis proline' 0 N--CA 1.498 1.743 0 C-N-CA 121.312 -2.37 . . . . 0.0 112.505 -20.699 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.4 m -58.15 -48.3 80.69 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.85 -158.628 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.76 -41.02 94.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.457 -168.81 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -77.76 -18.92 55.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.55 -176.911 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.215 -168.161 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.083 0 N-CA-C 113.418 0.507 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -148.23 165.51 30.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.388 -168.363 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.7 t -78.93 135.83 58.68 Favored Pre-proline 0 C--O 1.244 0.803 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.434 -162.489 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.6 Cg_exo -69.85 -26.39 27.19 Favored 'Trans proline' 0 N--CA 1.484 0.966 0 C-N-CA 123.437 2.758 . . . . 0.0 113.358 166.826 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.401 ' HE3' ' NZ ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -85.97 -65.85 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.365 -167.296 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -97.4 -25.84 15.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.577 -163.965 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.7 t70 72.77 69.7 0.13 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.504 -164.544 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 0.2 OUTLIER -129.6 -168.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.158 163.22 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.69 148.37 28.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.406 160.851 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.4 t -107.71 112.45 40.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.902 -165.919 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CZ ' ' A' ' 12' ' ' PHE . 17.7 t80 -66.95 160.91 25.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.354 176.342 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CZ ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -62.24 -76.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.221 -167.868 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.76 -0.31 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.45 -162.553 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -105.7 16.59 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.279 177.064 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.56 157.8 16.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.263 -166.148 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.549 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.89 123.09 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.82 160.393 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 84.9 m -100.62 135.28 42.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.443 -167.259 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.459 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 6.9 t -177.91 130.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.438 -166.061 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.4 mm? 60.04 37.69 21.03 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.663 -175.158 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.22 17.61 46.38 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 165.709 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -151.33 123.15 8.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.039 168.019 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 6.7 m-20 -63.56 -179.34 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.351 -162.703 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 50.4 m95 -145.79 169.68 18.04 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.708 -178.077 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -92.85 144.02 25.69 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.52 170.245 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.542 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 ttp85 -61.16 -49.51 88.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 -169.833 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 2.9 Cg_exo -57.8 -33.68 97.23 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.692 2.261 . . . . 0.0 113.504 172.728 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.17 -55.81 8.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.28 -171.194 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.688 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.9 tp -60.7 87.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.345 -167.054 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.401 ' NZ ' ' HE3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -129.08 153.39 47.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.224 -170.874 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -65.6 171.38 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.441 164.688 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.537 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 38.6 tt0 -121.54 -21.64 6.16 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.707 173.322 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -94.7 -39.42 10.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.501 -167.53 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.9 p -105.98 -42.49 5.1 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.0 174.701 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.462 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 86.41 58.04 2.01 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 175.601 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.28 139.2 49.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.364 167.792 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 158.27 18.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.32 -176.645 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.6 mt -119.96 137.04 54.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.434 -166.235 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 39' ' ' SER . 39.4 m -67.61 169.76 8.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.523 -178.571 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG22 ' A' ' 38' ' ' THR . 2.3 m -69.55 76.67 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.436 -175.27 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.28 56.64 1.44 Allowed Glycine 0 CA--C 1.529 0.918 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 169.633 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.8 10.72 3.68 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-N 114.908 -0.646 . . . . 0.0 111.824 166.972 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.688 ' CE1' HD11 ' A' ' 28' ' ' LEU . 2.8 p80 -103.54 -170.45 1.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.328 -177.102 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -132.51 -171.72 2.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.061 165.19 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -170.98 154.49 4.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.972 -172.624 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 14.4 p80 -105.86 -169.3 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.067 160.006 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -62.53 81.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.272 -177.424 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 124.18 -33.8 3.73 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 168.651 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.9 OUTLIER -124.51 109.1 28.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-O 121.574 0.702 . . . . 0.0 109.735 -165.199 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.5 Cg_endo -63.7 148.41 92.16 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.651 2.234 . . . . 0.0 113.642 173.122 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 5.1 m-85 -135.44 -168.03 2.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.815 165.684 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 52.8 m -58.45 -169.45 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.974 -1.467 . . . . 0.0 110.489 164.184 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.697 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 0.7 OUTLIER -100.77 -37.67 8.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.23 163.046 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 35.4 m-70 -157.79 172.8 5.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-O 122.195 0.998 . . . . 0.0 109.456 167.154 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 27.0 Cg_endo -63.59 -11.53 4.19 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.486 -2.297 . . . . 0.0 112.516 -19.081 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 58.6 m -58.27 -40.57 82.22 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.71 -158.615 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -61.12 -30.99 70.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.276 -172.714 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.3 t -108.26 24.16 13.43 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.488 176.468 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.165 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.246 -175.28 . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.636 0.591 . . . . 0.0 113.636 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.94 168.31 20.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.413 177.941 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 12.6 t -77.53 130.93 72.59 Favored Pre-proline 0 C--O 1.246 0.869 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.554 -163.092 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.636 ' HG3' ' HG3' ' A' ' 21' ' ' LYS . 4.1 Cg_exo -68.91 -14.82 39.47 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 C-N-CA 123.23 2.62 . . . . 0.0 113.397 168.679 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.56 ' HE2' ' HD2' ' A' ' 49' ' ' PRO . 8.9 tptp -95.68 -72.36 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.235 -169.545 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -91.74 -23.17 19.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.568 -163.098 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 74.12 55.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 -167.621 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.27 176.91 6.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.699 155.915 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.85 151.26 19.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.783 171.997 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 70.5 t -113.25 111.05 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.852 -163.535 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.33 -167.99 1.04 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.405 -173.779 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -62.56 -83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.203 -164.934 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.58 -15.41 59.25 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.609 -163.233 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -95.87 41.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.98 174.348 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.4 140.88 47.69 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.598 170.781 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 134.32 61.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.838 159.285 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -103.01 139.06 39.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.422 -169.039 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.485 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 3.6 t -177.63 122.55 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.193 -165.965 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.685 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.23 32.6 20.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.506 -171.218 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.42 61.69 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 164.163 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -145.15 125.52 13.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 164.204 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.444 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -66.94 179.81 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.411 -161.028 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.1 m95 -148.34 175.81 10.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 114.205 -1.361 . . . . 0.0 109.724 -176.916 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -95.35 150.26 20.46 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.563 172.24 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.442 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.09 86.12 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.873 -167.594 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -65.51 -36.19 35.28 Favored 'Trans proline' 0 N--CA 1.483 0.89 0 C-N-CA 122.696 2.264 . . . . 0.0 113.526 176.267 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.2 -47.12 87.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.201 -165.174 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.959 HD21 ' NE2' ' A' ' 42' ' ' HIS . 5.0 tp -59.96 92.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.402 -159.774 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.559 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -132.29 165.11 24.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.252 -171.257 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.9 t -61.4 179.39 0.22 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.307 172.333 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.487 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 2.6 tp10 -143.93 22.99 1.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.967 162.605 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.449 ' HG2' ' HE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -128.79 -37.23 1.76 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.719 -171.426 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.4 p -106.97 -48.3 3.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.483 165.938 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.99 58.32 0.88 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -169.648 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.6 141.39 46.61 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.966 -0.617 . . . . 0.0 110.459 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.559 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -74.66 152.67 39.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.405 -170.455 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.52 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 22.9 mt -117.87 161.13 20.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.336 -168.529 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -103.99 -175.01 2.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.367 -167.511 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 1.5 p -61.04 -18.68 59.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.383 -167.823 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.69 68.32 0.03 OUTLIER Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 169.548 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.08 10.55 5.93 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 167.356 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.959 ' NE2' HD21 ' A' ' 28' ' ' LEU . 3.8 p80 -93.0 -169.74 2.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.415 176.793 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -131.66 -168.79 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.142 168.286 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.519 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -166.67 160.61 15.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.049 168.144 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.46 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 85.5 t60 -132.44 72.06 1.49 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.96 -177.335 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 58.4 87.17 0.08 Allowed 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.918 -179.603 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.81 -21.27 46.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 165.086 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -132.51 96.38 19.01 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.669 0.747 . . . . 0.0 109.866 -167.991 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.56 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 16.1 Cg_endo -59.49 142.67 99.29 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 122.256 1.97 . . . . 0.0 113.627 175.752 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 73.6 m-85 -135.72 -177.1 4.52 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.017 176.461 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 65.4 m -58.98 -178.21 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.526 168.344 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.78 -27.95 14.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.018 160.976 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 23.1 m80 -169.52 166.53 5.78 Favored Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.497 172.119 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.522 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 Cg_endo -69.16 -6.75 8.6 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.574 -1.844 . . . . 0.0 113.673 -12.071 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HA ' ' HB2' ' A' ' 58' ' ' ALA . 66.4 m -60.52 -49.56 77.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.401 -162.727 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.92 -38.07 84.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.418 -171.455 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.07 32.91 4.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.496 170.208 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.517 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.284 169.742 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.479 0.53 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HD2' ' CG ' ' A' ' 9' ' ' GLU . 1.7 mmtp 63.71 156.68 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.343 170.614 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.4 t -80.46 132.33 59.04 Favored Pre-proline 0 C--O 1.244 0.787 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.408 -162.006 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.0 Cg_exo -69.06 -19.78 38.99 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 123.267 2.644 . . . . 0.0 113.312 167.128 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -70.86 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.353 -166.304 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -91.19 -24.07 20.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 -165.142 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 73.45 58.3 0.1 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.534 -167.48 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.5 -168.88 1.56 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.891 158.904 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.406 ' CG ' ' HD2' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -109.76 152.09 26.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.574 160.219 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -107.59 110.33 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.746 -163.845 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -74.43 178.23 5.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.151 -179.63 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -61.4 -84.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.567 -165.071 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -6.49 35.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.861 -158.802 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 17.71 11.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.287 -176.858 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.441 ' H ' ' HD2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -85.2 154.29 22.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.246 -163.971 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 28' ' ' LEU . 11.4 m -148.31 121.88 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.254 161.025 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.7 m -102.5 135.4 44.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.389 -163.921 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.496 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 17.7 t -177.99 132.55 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.408 -166.625 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.1 34.68 21.27 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.65 -177.276 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.47 18.17 50.03 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 167.268 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -150.34 125.08 9.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.053 166.703 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.86 -179.77 0.3 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.448 -162.592 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.4 m95 -145.91 -172.14 3.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.066 -1.425 . . . . 0.0 109.446 179.773 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -103.16 148.86 25.24 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.544 169.39 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.566 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 30.4 ttt180 -65.56 -50.36 56.96 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.79 -174.225 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.2 Cg_endo -57.31 -22.81 51.27 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 122.531 2.154 . . . . 0.0 113.542 174.152 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -84.16 -57.91 2.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.299 -170.757 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.805 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -60.79 93.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.456 -166.461 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.5 mtpm? -148.89 150.8 33.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 -174.912 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -66.54 136.08 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.198 161.896 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -115.22 33.41 5.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.044 167.559 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -46.82 3.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.679 167.676 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.3 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.85 179.982 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.52 51.61 3.82 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.456 -1.057 . . . . 0.0 110.456 169.063 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -128.39 128.38 44.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.109 -0.546 . . . . 0.0 110.405 -176.268 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.469 ' HA ' ' CG ' ' A' ' 29' ' ' LYS . 55.8 m -60.98 139.22 58.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.298 168.563 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 13.5 mt -104.8 166.72 10.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.394 -166.359 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.558 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -94.2 -172.01 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.37 -167.935 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.558 ' H ' HG22 ' A' ' 38' ' ' THR . 6.9 p -61.02 -18.35 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.368 -168.141 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.61 0.02 OUTLIER Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 169.05 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.37 10.58 9.9 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 165.938 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.805 ' CE1' HD11 ' A' ' 28' ' ' LEU . 7.3 p80 -94.57 -169.91 2.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.422 177.614 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.566 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -137.61 -164.25 1.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.167 168.634 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -160.18 148.34 16.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.231 174.329 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -128.0 70.32 1.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.884 -166.642 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 58.36 89.64 0.05 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.898 -178.473 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.75 -28.86 12.54 Favored Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 164.847 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -141.98 137.42 15.94 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 121.439 0.637 . . . . 0.0 109.779 -173.553 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.9 Cg_endo -63.57 150.83 87.53 Favored 'Trans proline' 0 N--CA 1.486 1.05 0 C-N-CA 122.649 2.233 . . . . 0.0 113.505 169.067 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 86.1 m-85 -141.05 -164.9 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.949 162.799 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 13.5 m -57.43 -177.52 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.641 167.602 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.566 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -100.38 -26.12 13.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.844 158.351 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.538 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 25.3 m80 -170.82 166.22 4.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 CA-C-N 114.645 -1.162 . . . . 0.0 109.343 172.178 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 8.2 Cg_endo -71.08 -7.84 12.62 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.656 -1.81 . . . . 0.0 113.604 -12.279 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.8 m -60.06 -32.42 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.534 -160.87 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -77.19 -36.08 55.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.334 -172.538 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.538 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 19.6 m -93.55 24.04 4.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.467 169.813 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.478 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.245 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.345 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.441 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 3.7 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 N-CA-C 113.513 0.543 . . . . 0.0 113.513 . . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.84 143.48 0.74 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.271 -168.541 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.1 t -80.79 131.08 61.5 Favored Pre-proline 0 C--O 1.245 0.85 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.399 -162.361 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 5.3 Cg_exo -68.56 -15.85 41.95 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 123.277 2.651 . . . . 0.0 113.372 168.39 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.37 -71.41 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.384 -167.743 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.6 p -91.53 -23.02 20.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.474 -162.249 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 t0 73.71 57.34 0.1 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.535 -166.444 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 174.68 8.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.971 158.556 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.14 150.5 20.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.701 168.205 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 55.6 t -111.4 113.63 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.829 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 12' ' ' PHE . 60.7 t80 -66.11 170.06 6.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.421 177.278 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.493 ' N ' ' CD2' ' A' ' 11' ' ' TYR . 38.3 m-85 -61.89 -82.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.515 -169.347 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.74 -10.96 60.37 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.758 -162.598 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -103.8 44.49 1.02 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.06 168.848 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -109.7 151.49 26.84 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.444 171.117 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.468 HG21 HD22 ' A' ' 28' ' ' LEU . 17.5 m -136.66 147.54 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.863 160.165 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 m -116.22 135.31 54.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.443 -166.783 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.459 ' C ' HD22 ' A' ' 19' ' ' LEU . 13.7 t -178.17 123.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -171.156 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.26 32.42 20.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.423 -171.029 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.28 18.72 65.52 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 162.883 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.55 128.26 19.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 166.377 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.46 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -69.77 177.75 2.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.367 -164.286 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.7 m95 -146.49 178.22 8.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.614 -176.253 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.7 m80 -98.79 140.22 33.3 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 114.075 -1.421 . . . . 0.0 110.494 169.035 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.588 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.38 -46.67 94.87 Favored Pre-proline 0 CA--C 1.544 0.73 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.848 -172.103 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 11.8 Cg_exo -48.78 -37.26 35.27 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.713 2.275 . . . . 0.0 113.486 167.781 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.45 -58.79 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.359 -165.389 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.808 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.0 tp -60.54 89.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.368 -164.575 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 mtmt -128.99 177.03 7.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.112 168.482 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.9 t -59.82 166.6 2.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.401 169.057 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -131.33 25.51 4.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.766 162.006 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tppm? -114.19 -63.59 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.324 169.147 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -92.05 -42.02 10.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.493 -165.333 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.2 62.5 0.81 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 -171.128 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -132.87 144.9 50.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.469 173.972 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.97 143.68 50.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.497 170.053 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HB3' ' CG ' ' A' ' 42' ' ' HIS . 88.0 mt -109.08 -168.22 1.31 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.437 -169.412 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.8 170.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.249 -167.385 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.01 18.5 11.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.423 -175.716 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.62 50.61 0.06 OUTLIER Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 162.8 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 58.34 54.1 40.41 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 156.515 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.808 ' NE2' HD21 ' A' ' 28' ' ' LEU . 15.7 p80 -60.43 -170.7 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.029 -0.585 . . . . 0.0 110.586 178.25 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB1' ' CE1' ' A' ' 56' ' ' TYR . . . -135.63 175.69 9.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.404 -177.672 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -160.49 141.49 11.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.068 166.117 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.69 ' CD2' ' CD1' ' A' ' 50' ' ' TYR . 21.4 m-70 -88.79 -42.16 12.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.388 -166.695 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.49 47.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.043 -171.31 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 21.59 53.59 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 -177.473 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -141.18 96.04 7.28 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.852 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.2 Cg_endo -62.97 144.49 93.19 Favored 'Trans proline' 0 N--CA 1.485 0.99 0 C-N-CA 122.714 2.276 . . . . 0.0 113.66 -170.217 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.69 ' CD1' ' CD2' ' A' ' 45' ' ' HIS . 1.3 m-85 -126.62 -174.12 3.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 169.969 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 64.3 m -59.2 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.123 -1.398 . . . . 0.0 110.511 169.297 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -110.47 -32.68 6.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.74 158.404 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.551 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.3 m80 -145.23 175.01 2.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.365 162.647 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.7 Cg_endo -59.76 -15.66 2.49 Favored 'Cis proline' 0 N--CA 1.5 1.868 0 C-N-CA 120.651 -2.645 . . . . 0.0 112.331 -25.354 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.8 m -59.14 -50.61 73.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.798 -160.278 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.591 ' CE1' ' HB1' ' A' ' 43' ' ' ALA . 11.0 t80 -69.14 -41.21 77.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.462 -172.139 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.551 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 26.9 t -68.9 -21.35 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.415 179.785 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.29 -171.684 . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.416 ' HA ' ' OD1' ' A' ' 22' ' ' ASP . 10.1 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -61.01 146.93 45.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.344 -167.402 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.543 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 22.9 t -79.93 129.36 70.77 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.383 -163.86 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.3 Cg_endo -67.88 -18.65 46.93 Favored 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 123.25 2.634 . . . . 0.0 113.497 169.088 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -68.61 0.78 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.251 -166.335 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -94.77 -24.42 17.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.479 -163.358 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t70 73.65 65.88 0.09 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.47 -165.767 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -129.04 -168.47 1.93 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.927 159.573 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.42 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -107.49 147.08 30.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.207 163.52 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.931 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.3 t -105.59 116.47 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.767 -163.741 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -166.85 0.65 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.289 -178.889 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.91 -83.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.48 -167.67 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.83 -12.47 61.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.726 -159.081 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -94.44 17.13 13.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.199 179.894 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.1 ptt-85 -88.53 149.24 23.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.329 -168.249 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 m -148.25 119.54 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.067 161.66 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 42.9 m -93.03 137.16 32.63 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.397 -174.792 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.488 ' C ' HD22 ' A' ' 19' ' ' LEU . 2.0 t -174.33 129.68 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.276 -168.815 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.641 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.98 31.85 20.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.571 -171.781 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.6 61.91 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 166.272 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -147.29 122.57 10.26 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 164.553 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -63.25 -179.82 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.381 -162.011 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.6 m95 -145.78 178.25 8.3 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.742 -178.015 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.931 ' CD2' HG22 ' A' ' 10' ' ' VAL . 48.2 m80 -98.24 146.53 25.54 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.202 -1.363 . . . . 0.0 110.51 171.055 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 tpt180 -62.04 -47.36 90.96 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.719 -171.949 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -62.85 -28.34 75.62 Favored 'Trans proline' 0 N--CA 1.484 0.961 0 C-N-CA 122.491 2.127 . . . . 0.0 113.531 176.915 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.23 -49.43 19.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.136 -165.743 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.825 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -73.03 94.55 1.9 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.341 -160.449 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.34 170.04 15.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.075 163.719 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -60.06 -174.89 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.318 172.144 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -144.65 22.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.65 157.327 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.02 -33.04 1.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.553 -165.106 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.5 p -110.7 -53.01 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.504 163.999 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.24 68.23 0.61 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -169.114 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -144.18 162.69 35.68 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.449 -178.778 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.07 156.49 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.424 169.88 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' A' ' 42' ' ' HIS . 5.8 mt -129.53 173.84 10.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.261 -166.851 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.21 -162.43 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.351 -160.394 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 2.9 p -61.08 -85.44 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.424 -177.863 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.33 48.36 1.03 Allowed Glycine 0 CA--C 1.539 1.543 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 159.498 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.82 -105.85 0.01 OUTLIER Glycine 0 CA--C 1.533 1.162 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 152.443 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.886 ' HB3' HD22 ' A' ' 37' ' ' LEU . 4.3 p80 -58.74 -170.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.862 -0.669 . . . . 0.0 110.806 -163.675 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.579 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -125.55 -166.9 1.61 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.96 160.965 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.498 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -135.73 146.44 47.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.071 -176.31 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -147.48 112.1 5.32 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.759 178.589 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.65 43.1 19.42 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.603 167.739 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.92 46.13 18.24 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 165.629 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 pttt 176.26 97.3 0.1 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -178.184 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.8 144.08 96.62 Favored 'Trans proline' 0 N--CA 1.484 0.955 0 C-N-CA 122.936 2.424 . . . . 0.0 113.555 -167.562 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.9 OUTLIER -131.55 171.18 13.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.728 161.973 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 55.8 m -58.62 145.45 39.6 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 113.836 -1.529 . . . . 0.0 110.81 174.646 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.25 -34.92 75.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.383 -1.28 . . . . 0.0 110.369 175.291 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 33.3 m80 -163.07 165.22 15.04 Favored Pre-proline 0 CA--C 1.549 0.909 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.529 166.729 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -69.89 -6.08 9.43 Favored 'Cis proline' 0 N--CA 1.483 0.881 0 C-N-CA 122.594 -1.836 . . . . 0.0 113.689 -11.523 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 93.2 m -60.37 -50.37 73.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.577 -161.693 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -62.03 -37.86 86.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.351 -172.307 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.24 29.28 7.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.474 175.751 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.365 171.212 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.484 0.955 0 N-CA-C 113.494 0.536 . . . . 0.0 113.494 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 15.3 tttt 65.2 153.58 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.47 165.903 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 15.1 t -72.41 128.61 88.47 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.584 -166.663 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 3.7 Cg_exo -69.99 -7.86 22.17 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.363 2.708 . . . . 0.0 113.39 168.946 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -70.86 0.71 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.276 -173.648 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -97.03 -21.73 17.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.656 -161.152 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t0 73.75 62.98 0.09 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.529 -167.897 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -140.06 166.71 23.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.895 158.947 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.499 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -85.23 152.39 23.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.836 179.609 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' NE2' ' A' ' 24' ' ' HIS . 98.8 t -124.65 125.36 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.334 -164.013 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 12' ' ' PHE . 9.7 t80 -172.23 136.79 0.85 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -159.64 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 11' ' ' TYR . 2.2 m-85 70.64 178.12 0.26 Allowed 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -162.677 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.27 -0.5 10.11 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.584 -155.443 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.31 -18.92 52.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.41 171.081 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.714 ' CB ' HG12 ' A' ' 10' ' ' VAL . 9.8 ptm180 -87.03 127.64 35.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.307 -168.432 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.3 m -127.85 171.33 16.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.091 166.18 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -127.31 137.62 52.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.452 -167.585 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 10.1 t -176.05 126.65 0.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.315 -175.746 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.679 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.22 24.59 13.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.473 -171.622 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.37 -24.76 25.89 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 162.908 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 1.5 mptp? -113.45 132.17 55.75 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.23 -178.263 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 9.1 m-20 -70.47 179.35 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.32 -163.246 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.63 164.8 34.17 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.732 -176.923 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.932 ' NE2' HG22 ' A' ' 10' ' ' VAL . 35.9 m80 -85.35 137.06 33.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.481 164.412 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 3.9 tpm_? -61.21 -49.45 88.16 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.817 -172.651 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.57 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.9 Cg_endo -58.58 -16.7 31.3 Favored 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 122.568 2.179 . . . . 0.0 113.569 174.234 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.88 -49.41 7.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.298 -177.223 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.052 HD21 ' CE1' ' A' ' 42' ' ' HIS . 1.7 tp -62.92 86.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.378 -167.226 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 11.9 mtmt -133.86 163.8 28.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.359 -178.159 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -64.53 157.78 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 168.157 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -126.31 24.91 6.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.997 164.366 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HE2' ' HB2' ' A' ' 58' ' ' ALA . 3.6 tttp -109.29 -64.15 1.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.198 163.01 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -92.8 -19.08 22.1 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.517 -165.084 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.91 53.4 3.53 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 167.554 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -143.93 147.52 34.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.058 -0.571 . . . . 0.0 110.433 179.796 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -61.49 171.64 1.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.508 176.54 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.3 mt -133.14 176.58 8.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.285 -177.498 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -111.03 -174.68 2.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.376 -165.804 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.615 ' H ' HG22 ' A' ' 38' ' ' THR . 29.8 t -61.11 -15.5 33.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.437 -170.02 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.56 67.16 0.03 OUTLIER Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 167.519 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -122.62 11.77 8.92 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 165.775 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 1.052 ' CE1' HD21 ' A' ' 28' ' ' LEU . 28.4 p-80 -97.2 -169.19 1.82 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.876 -0.662 . . . . 0.0 110.369 174.754 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.98 -165.64 2.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.246 166.32 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.434 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 20.3 tt0 -158.32 151.16 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.997 -174.821 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -93.19 16.26 13.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.562 171.216 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 58.7 72.95 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.675 -169.585 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 167.64 -41.98 0.24 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -179.634 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.85 134.3 4.31 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-O 121.494 0.664 . . . . 0.0 109.652 169.65 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 18.9 Cg_endo -60.62 145.46 98.8 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 C-N-CA 122.42 2.08 . . . . 0.0 113.625 -178.413 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 3.0 m-85 -133.53 -164.81 1.54 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.76 162.268 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 60.1 m -59.09 -171.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.418 167.794 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -99.86 -31.85 11.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.12 163.186 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.5 m80 -168.23 165.3 7.84 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.542 171.652 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.512 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.3 Cg_endo -70.44 -5.58 10.01 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.637 -1.818 . . . . 0.0 113.672 -10.789 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 65.0 m -60.07 -39.75 87.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.494 -161.412 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -67.95 -36.75 80.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.426 -170.957 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.9 p -100.25 21.04 13.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.434 174.768 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.534 ' HB2' ' HE2' ' A' ' 32' ' ' LYS . . . . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.425 172.12 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.486 1.061 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.582 ' HG2' ' HB3' ' A' ' 9' ' ' GLU . 16.5 mtpt 61.94 167.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.379 168.837 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.5 t -80.28 127.36 76.61 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.457 -164.224 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -67.07 -13.86 41.34 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 123.228 2.619 . . . . 0.0 113.465 167.447 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.45 -73.11 0.59 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.41 -172.245 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -91.44 -13.42 32.33 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.479 -168.202 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.11 56.96 3.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.655 -167.99 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 2.5 tttt -110.17 -167.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.965 158.925 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.582 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -107.86 149.57 28.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.263 162.863 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.93 HG22 ' CD2' ' A' ' 24' ' ' HIS . 66.1 t -111.13 113.84 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.921 -166.9 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.07 -168.61 1.32 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.365 175.78 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -72.43 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.451 -165.446 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.77 -1.14 8.41 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.036 -0.666 . . . . 0.0 111.62 -161.076 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.4 17.53 23.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.386 178.348 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 151.97 19.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.311 -165.079 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.813 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.98 145.37 18.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.916 160.151 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 28.2 m -118.9 134.83 54.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -167.56 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.499 ' HB2' ' CE1' ' A' ' 42' ' ' HIS . 20.7 t -178.18 131.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.316 -169.87 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.1 mm? 60.19 20.65 10.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.454 -169.435 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.68 -24.39 28.2 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 165.438 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.39 141.66 45.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.843 -0.678 . . . . 0.0 110.224 -177.593 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.4 177.01 9.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.394 -164.562 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.6 m95 -146.95 179.67 7.44 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.665 -176.181 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.93 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.4 m80 -100.07 136.56 39.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.468 165.424 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HD3' HG11 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -67.77 -47.09 44.8 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.85 -172.121 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -47.72 -38.71 29.89 Favored 'Trans proline' 0 N--CA 1.485 1.006 0 C-N-CA 122.711 2.274 . . . . 0.0 113.46 166.525 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -68.05 -56.41 8.99 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.255 -178.393 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.813 HD22 HG21 ' A' ' 16' ' ' VAL . 5.7 tp -60.46 89.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.37 -163.768 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.0 pttt -132.4 160.01 37.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.36 171.773 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.2 t -60.74 158.69 12.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.276 167.239 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 23.5 pt-20 -134.44 23.55 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.577 159.043 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -36.62 5.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.505 -179.764 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.6 -52.62 2.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.463 164.838 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 114.56 57.86 0.37 Allowed Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 172.027 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -136.82 143.1 42.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.412 168.836 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -61.77 157.59 17.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.475 175.206 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.81 HD13 ' HB2' ' A' ' 42' ' ' HIS . 6.6 mt -116.19 -173.09 2.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.342 -171.013 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.31 -176.72 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.341 -167.363 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 28.2 p -61.58 -21.39 64.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.387 -168.513 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.04 53.63 0.06 OUTLIER Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.728 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.49 10.58 14.44 Favored Glycine 0 CA--C 1.522 0.475 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 167.099 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.81 ' HB2' HD13 ' A' ' 37' ' ' LEU . 13.4 p-80 -86.57 -170.0 2.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.231 -0.485 . . . . 0.0 110.386 174.629 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -154.45 -168.97 3.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.142 166.687 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.7 152.88 3.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.947 -168.45 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -130.87 73.52 1.55 Allowed 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.97 179.731 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.48 83.63 0.12 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.916 -176.465 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.36 45.93 66.52 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 167.397 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.34 90.11 0.51 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.538 0.685 . . . . 0.0 109.845 169.838 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.89 145.25 99.32 Favored 'Trans proline' 0 N--CA 1.485 1.023 0 C-N-CA 122.514 2.143 . . . . 0.0 113.691 -178.318 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 54.1 m-85 -144.48 -159.8 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.906 167.888 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 36.4 m -55.39 179.61 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.26 170.886 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -105.15 -29.42 10.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.605 157.66 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.38 166.14 16.84 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.276 164.923 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -69.83 -14.69 12.63 Favored 'Cis proline' 0 N--CA 1.482 0.81 0 C-N-CA 122.41 -1.912 . . . . 0.0 113.654 -13.629 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.7 m -59.85 -49.56 77.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.511 -160.032 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.84 -48.73 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.265 -170.812 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.492 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 6.8 m -72.89 -18.74 61.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.383 -174.471 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.264 -170.289 . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.613 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 21.7 Cg_exo . . . . . 0 N--CA 1.485 0.982 0 N-CA-C 113.569 0.565 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER 66.12 125.84 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.672 165.605 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 21.7 t -93.96 120.83 65.36 Favored Pre-proline 0 C--O 1.245 0.829 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.575 -168.44 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.596 ' HD2' ' CD2' ' A' ' 23' ' ' TRP . 4.3 Cg_exo -75.97 -5.66 16.58 Favored 'Trans proline' 0 N--CA 1.483 0.856 0 C-N-CA 123.201 2.601 . . . . 0.0 113.818 173.628 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.527 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.94 -78.65 0.38 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.573 -179.719 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -77.04 -23.21 52.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.501 -173.016 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 71.89 47.7 0.31 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.475 -173.762 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.7 -168.91 1.61 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.829 159.277 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -108.67 154.65 21.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.708 160.975 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.1 t -114.94 115.36 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.403 -162.894 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -92.17 55.09 2.5 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.852 -156.942 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 67.54 -79.99 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.594 173.668 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.07 0.11 25.91 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.383 -162.48 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -107.0 12.69 28.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.254 175.954 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.05 26.06 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.271 -163.083 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.647 ' CG2' HD22 ' A' ' 28' ' ' LEU . 15.8 m -148.27 121.89 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.843 158.265 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 90.1 m -97.48 136.72 37.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.414 -161.659 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' HD22 ' A' ' 19' ' ' LEU . 23.0 t -178.2 137.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.428 -167.799 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.613 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 60.04 22.11 11.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.625 -171.248 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.05 -23.14 22.31 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 168.797 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 21' ' ' LYS . 14.8 mmmt -122.31 126.73 48.72 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.739 -0.731 . . . . 0.0 110.021 -176.634 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.613 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -60.43 -175.47 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.365 -160.995 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.596 ' CD2' ' HD2' ' A' ' 4' ' ' PRO . 72.5 m95 -146.49 -172.79 4.03 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 112.892 -1.958 . . . . 0.0 109.501 179.127 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.0 m80 -100.75 153.01 19.81 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.612 165.211 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -69.22 -63.85 1.89 Allowed Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.788 179.943 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -50.84 -17.56 3.37 Favored 'Trans proline' 0 N--CA 1.485 1.013 0 C-N-CA 122.301 2.001 . . . . 0.0 113.455 177.337 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -80.99 -52.89 6.94 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.394 178.692 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.907 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.9 tp -72.98 82.84 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.319 -163.952 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -138.45 172.07 13.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.304 167.931 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -67.97 157.68 34.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.357 174.297 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.36 23.67 5.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.749 161.399 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.417 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -116.95 -41.36 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.471 -171.45 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -110.98 -52.44 2.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.782 173.264 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.05 59.01 0.25 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 173.076 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.0 mtpp -149.07 168.28 23.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.408 -177.568 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' LEU . 8.0 m -92.87 168.05 11.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.381 -178.78 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.745 HD13 ' CB ' ' A' ' 42' ' ' HIS . 4.1 mt -131.65 131.45 43.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.419 -167.563 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -155.91 -170.15 3.31 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.232 173.014 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.507 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER 63.42 14.74 8.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.026 -163.45 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.31 45.89 95.3 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 -162.734 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -94.13 9.9 72.13 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 -163.385 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.907 ' CE1' HD21 ' A' ' 28' ' ' LEU . 30.4 p-80 -106.32 -171.6 1.93 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.142 0.496 . . . . 0.0 110.545 -173.656 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -176.37 159.63 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.134 175.74 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.423 ' HG2' HD11 ' A' ' 19' ' ' LEU . 1.1 pt-20 -109.47 140.7 42.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.961 -165.134 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -94.41 41.22 1.09 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.797 1.284 . . . . 0.0 109.506 161.89 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.5 98.78 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.622 -171.833 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.22 37.22 43.03 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 168.4 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mttt 179.95 96.31 0.19 Allowed Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.238 0.542 . . . . 0.0 109.724 172.892 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -63.52 146.5 92.94 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 C-N-CA 122.754 2.302 . . . . 0.0 113.546 -173.521 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -145.13 -162.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.938 166.411 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.7 m -57.52 179.45 0.06 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.724 167.925 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.54 -27.56 12.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.066 161.426 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.535 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 33.4 m80 -164.83 166.99 10.47 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.464 170.178 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.674 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 11.5 Cg_endo -68.69 -7.94 8.47 Favored 'Cis proline' 0 N--CA 1.482 0.834 0 C-N-CA 122.513 -1.87 . . . . 0.0 113.702 -12.693 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.1 m -60.48 -52.71 64.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.417 -162.461 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -60.72 -33.37 72.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.394 -168.366 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.08 26.78 10.26 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.322 179.97 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.323 178.783 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 11.9 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 160.89 30.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.406 -168.57 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.2 t -81.15 130.82 61.29 Favored Pre-proline 0 C--O 1.246 0.872 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.461 -162.689 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -69.08 -18.13 40.33 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 123.379 2.719 . . . . 0.0 113.368 166.908 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 -70.9 0.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.381 -167.301 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.1 p -91.65 -24.17 19.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.432 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 73.03 54.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.505 -167.609 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 4.2 tptp -112.64 -169.27 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.822 158.409 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -109.52 150.97 27.37 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.526 161.386 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -107.74 114.9 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.63 -165.439 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -101.36 56.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.023 0.915 . . . . 0.0 110.079 -158.906 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.27 -80.59 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.354 170.8 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.02 -6.37 56.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.414 -157.615 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -114.09 41.66 2.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.082 163.502 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -86.45 149.16 25.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.367 177.758 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.429 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -147.12 122.4 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.623 158.392 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.6 m -100.02 136.89 39.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.399 -162.252 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.7 t -177.67 127.18 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.307 -166.361 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 60.12 29.79 19.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.699 -171.758 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.51 17.19 47.17 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 167.57 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.24 119.33 12.75 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 164.903 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 17.4 m-20 -62.03 -178.21 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.396 -159.291 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 51.2 m95 -146.47 -174.41 4.45 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 113.838 -1.528 . . . . 0.0 109.473 179.42 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.3 m80 -100.57 154.61 18.43 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.59 172.021 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.547 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.84 -56.75 29.26 Favored Pre-proline 0 C--O 1.241 0.634 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.851 -173.851 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.8 Cg_exo -64.01 -27.87 66.09 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 122.695 2.263 . . . . 0.0 113.545 -179.178 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -69.95 -53.49 17.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.218 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.911 HD21 ' CD2' ' A' ' 42' ' ' HIS . 2.2 tp -60.04 100.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.434 -159.082 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.446 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 4.5 mttt -132.64 147.28 52.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.217 -170.037 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -59.79 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.337 168.554 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.9 tt0 -146.47 25.41 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.753 157.722 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.11 -38.34 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.522 -169.045 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -104.88 -31.59 9.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.32 165.19 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 56.15 1.9 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 160.439 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.61 175.36 3.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.369 161.416 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.622 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -60.39 179.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.44 -162.095 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.756 HD13 ' HB3' ' A' ' 42' ' ' HIS . 6.8 mt -131.73 -172.18 2.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.3 -173.973 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 92.1 m -123.95 137.82 54.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 -176.025 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 t 59.69 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.558 165.372 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.58 44.1 0.18 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 160.224 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.08 11.08 56.35 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.878 -0.661 . . . . 0.0 111.553 -175.705 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.911 ' CD2' HD21 ' A' ' 28' ' ' LEU . 8.1 p80 -90.56 -169.49 2.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.897 -0.651 . . . . 0.0 110.39 172.041 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -154.27 154.45 33.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.14 166.837 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.505 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -100.3 146.92 26.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.155 -178.742 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -87.7 -45.88 9.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.813 166.1 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.82 79.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.009 166.264 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.78 -23.29 33.45 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 175.077 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 97.79 25.38 Favored Pre-proline 0 C--O 1.244 0.776 0 CA-C-N 115.003 -0.599 . . . . 0.0 109.697 -173.976 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.446 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 16.0 Cg_endo -65.77 142.05 68.26 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.629 2.219 . . . . 0.0 113.711 -170.161 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 1.9 m-85 -135.41 167.29 21.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.399 163.486 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 42.9 m -59.53 153.7 19.04 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 113.725 -1.58 . . . . 0.0 110.448 172.741 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -61.81 -45.91 91.79 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.321 179.001 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.5 m-70 -158.36 163.58 23.96 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.517 169.025 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -71.49 -3.8 10.76 Favored 'Cis proline' 0 N--CA 1.483 0.891 0 C-N-CA 122.748 -1.772 . . . . 0.0 113.817 -9.168 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 88.3 m -60.06 -59.16 5.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.407 -160.982 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -60.63 -40.74 93.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.454 -169.301 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.52 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 13.3 p -64.81 -21.29 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.422 176.835 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.228 -169.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.042 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -146.72 134.94 21.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.318 -169.399 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.4 t -84.38 114.94 57.96 Favored Pre-proline 0 C--O 1.25 1.123 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.158 -163.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -59.82 -20.54 59.73 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.787 2.325 . . . . 0.0 113.278 170.191 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -73.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.389 -175.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -93.55 -21.46 19.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.558 -165.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 72.61 57.22 0.13 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.47 -171.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.23 -168.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.99 159.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.46 152.24 22.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.572 162.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.9 t -112.09 112.35 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.627 -163.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 17.4 t80 -69.05 153.34 43.94 Favored 'General case' 0 N--CA 1.458 -0.038 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.285 176.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.495 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 2.7 m-85 -60.44 -62.05 2.15 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.835 -159.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.41 10.61 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.644 -173.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -102.55 13.95 33.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.449 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.0 154.72 17.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.228 -161.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.25 151.98 14.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.748 156.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.58 136.48 52.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.616 -169.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.9 t -174.83 131.83 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.185 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.593 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.1 mm? 60.04 34.52 21.39 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.558 -170.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.08 18.18 57.0 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 169.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -137.75 154.01 49.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 164.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.434 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.5 m-20 -88.14 176.9 7.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.367 -166.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -148.96 -177.25 5.7 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.251 -1.341 . . . . 0.0 109.074 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.7 m80 -99.54 143.22 30.03 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.475 169.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.71 -45.15 96.94 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.844 -167.209 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.3 Cg_endo -64.05 -36.46 48.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.589 2.192 . . . . 0.0 113.669 174.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.48 -46.71 84.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.233 -165.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.542 HD21 ' CE1' ' A' ' 42' ' ' HIS . 4.3 tp -62.77 83.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.367 -166.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -142.21 149.72 40.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.425 -166.336 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -65.5 127.59 32.46 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.472 175.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 1.2 tt0 -95.97 22.53 7.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.255 -1.338 . . . . 0.0 110.177 171.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 -58.98 2.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.318 169.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.2 p -104.81 -19.94 13.75 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.851 -170.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.89 37.19 34.14 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 176.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -96.1 128.12 42.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.496 -0.352 . . . . 0.0 110.335 167.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.2 m -61.14 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 42' ' ' HIS . 57.1 mt -98.08 167.22 11.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.378 -164.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 39' ' ' SER . 59.4 m -125.28 173.78 8.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.228 -164.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.574 ' N ' HG22 ' A' ' 38' ' ' THR . 1.0 OUTLIER -61.13 91.96 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.48 -178.51 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.53 57.1 8.54 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.22 12.78 3.55 Favored Glycine 0 CA--C 1.524 0.597 0 CA-C-N 114.757 -0.721 . . . . 0.0 111.701 166.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.658 ' HB2' HD13 ' A' ' 37' ' ' LEU . 43.1 p-80 -110.86 -168.96 1.37 Allowed 'General case' 0 C--O 1.231 0.084 0 CA-C-N 114.762 -0.719 . . . . 0.0 110.594 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.95 158.52 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.69 165.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -110.09 124.93 52.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.974 -160.302 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.513 ' CD2' ' CD1' ' A' ' 60' ' ' PHE . 57.6 t-80 -99.53 163.07 12.66 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.121 158.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.46 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 16.4 mp0 -60.31 92.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.241 -160.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.89 45.99 15.09 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.586 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HG3' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -177.97 104.81 0.21 Allowed Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 121.6 0.714 . . . . 0.0 109.956 169.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -61.77 172.57 3.63 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.603 2.202 . . . . 0.0 113.668 167.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 63.5 m-85 -169.11 177.55 4.8 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.01 -171.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 83.9 m -58.21 140.69 52.57 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.136 -1.393 . . . . 0.0 110.066 160.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.73 -38.94 86.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.191 164.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.467 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.7 m80 -153.21 173.45 4.59 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.342 165.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.8 Cg_endo -62.59 -18.71 4.6 Favored 'Cis proline' 0 N--CA 1.494 1.504 0 C-N-CA 121.248 -2.397 . . . . 0.0 112.537 -23.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.1 m -57.49 -41.69 81.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.146 -154.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -60.93 -48.02 83.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.412 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.403 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 24.8 t -72.03 -18.07 61.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.437 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.67 -47.2 7.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.288 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 49.9 mmm -93.53 -37.2 12.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.463 -169.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 45' ' ' HIS . 74.7 m-85 -119.41 81.34 1.7 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.353 177.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 168.38 143.39 3.8 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -173.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -58.13 145.69 91.31 Favored 'Trans proline' 0 N--CA 1.484 0.965 0 C-N-CA 122.464 2.11 . . . . 0.0 113.573 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -133.9 -175.43 3.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.389 -169.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.63 -129.93 3.91 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -66.81 -77.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.333 -0.434 . . . . 0.0 110.421 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 164.37 44.82 0.02 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -170.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -104.09 32.8 3.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.372 -170.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.52 154.66 38.08 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 178.87 7.64 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -170.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -97.18 -35.22 10.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.268 -169.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -165.51 -49.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.117 -168.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.3 m -100.86 123.74 45.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.385 169.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 -70.05 167.62 17.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.379 -169.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t -164.26 -166.5 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.47 170.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -67.8 84.87 0.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.316 -169.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt . . . . . 0 C--O 1.24 0.596 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.349 -170.062 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.427 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 14.4 Cg_exo . . . . . 0 N--CA 1.485 1.012 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.85 140.82 21.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.386 -167.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.7 t -86.96 116.47 66.17 Favored Pre-proline 0 C--O 1.25 1.108 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.104 -163.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.7 Cg_endo -59.51 -18.08 44.76 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 C-N-CA 122.784 2.322 . . . . 0.0 113.233 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -84.06 -69.44 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.466 -171.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.95 -21.92 18.3 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.638 -168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 t70 72.29 53.33 0.18 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.457 -171.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -111.7 -168.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.981 159.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.49 152.33 23.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.724 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.3 t -112.2 111.23 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.633 -163.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -73.65 157.63 36.24 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.287 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.17 -62.32 1.95 Allowed 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -158.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.62 -12.34 61.5 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.723 -173.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 1.6 mp0 -102.31 44.75 0.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.058 170.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -111.2 150.17 29.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.412 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.45 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -140.74 146.34 24.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.528 155.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -115.46 138.35 51.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.748 -166.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -178.19 132.09 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.22 -171.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.05 20.67 9.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.572 -171.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.85 -24.41 21.16 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 170.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -105.17 154.55 20.05 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 114.87 -0.665 . . . . 0.0 110.137 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -92.2 176.89 6.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.375 -165.258 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 24.1 m95 -150.49 -175.14 4.98 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.233 -1.348 . . . . 0.0 108.971 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.4 m80 -100.13 150.27 22.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 113.963 -1.471 . . . . 0.0 110.624 168.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 22.6 mtp180 -61.32 -56.56 32.76 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.922 -170.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 5.9 Cg_endo -58.77 -36.92 96.33 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.413 2.075 . . . . 0.0 113.567 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.81 -46.36 90.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.285 -164.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.681 HD21 ' CE1' ' A' ' 42' ' ' HIS . 7.8 tp -60.02 89.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.236 -160.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.1 tttp -138.4 146.57 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.307 -162.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -66.2 123.64 20.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.446 171.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB2' ' HE3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -96.72 36.95 1.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.954 168.615 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.84 -44.38 0.88 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.208 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.8 p -116.7 -21.62 8.99 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.006 176.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.94 44.51 11.94 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -105.39 131.06 53.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.422 170.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.2 m -61.0 147.35 43.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.368 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.588 HD13 ' CB ' ' A' ' 42' ' ' HIS . 60.7 mt -110.93 173.99 6.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.331 -168.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.592 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -122.01 -175.61 3.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.381 -167.054 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG22 ' A' ' 38' ' ' THR . 16.7 t -66.71 -18.94 65.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.376 -167.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.9 62.91 0.08 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 171.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -129.15 12.33 6.08 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.681 ' CE1' HD21 ' A' ' 28' ' ' LEU . 34.0 p-80 -103.87 -168.91 1.56 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.981 -0.609 . . . . 0.0 110.436 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.1 158.61 7.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.966 161.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.512 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 4.4 tt0 -115.19 121.31 42.57 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.015 -160.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.451 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -75.0 151.17 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.572 157.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.72 76.37 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.931 -176.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.39 -59.52 0.3 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -163.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.53 ' HE3' ' HB2' ' A' ' 31' ' ' GLU . 14.0 mtpp -155.32 140.19 12.05 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-O 121.339 0.59 . . . . 0.0 110.052 -160.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.653 ' HG3' HD12 ' A' ' 28' ' ' LEU . 12.2 Cg_endo -66.04 154.15 75.21 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.958 2.439 . . . . 0.0 113.568 165.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 28.7 m-85 -149.02 -167.24 2.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.84 166.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.6 m -57.7 134.24 56.04 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.287 166.075 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -68.22 -32.09 72.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.909 159.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.717 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 42.6 m80 -150.96 163.42 23.77 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.338 165.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -68.44 -22.53 8.56 Favored 'Cis proline' 0 N--CA 1.487 1.129 0 C-N-CA 122.427 -1.905 . . . . 0.0 112.798 -18.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 85.6 m -56.99 -43.02 81.32 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.214 -153.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -69.5 -37.8 77.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.471 170.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.717 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 48.1 t -60.77 -17.61 50.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.48 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -99.79 -38.96 8.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.187 -167.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.501 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 14.0 mmt -96.42 -21.49 17.73 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.431 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 59' ' ' MET . 49.7 m-85 -154.19 30.14 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.372 -167.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' A' ' 57' ' ' SER . . . -68.36 -52.52 26.2 Favored Glycine 0 CA--C 1.543 1.823 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -174.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 61' ' ' GLY . 2.9 Cg_exo -51.86 106.76 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.519 2.146 . . . . 0.0 113.434 -168.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' HG3' ' H ' ' A' ' 64' ' ' GLY . 2.8 tptp -98.8 157.56 16.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.467 169.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.413 ' H ' ' HG3' ' A' ' 63' ' ' LYS . . . 79.21 -135.43 15.41 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 -170.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -165.39 109.69 0.86 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.382 -170.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -127.57 47.12 1.04 Allowed Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 169.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -61.17 -43.26 99.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.387 170.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 176.41 -116.71 0.57 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -169.12 84.89 0.09 OUTLIER Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.34 162.26 17.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.425 . . . . 0.0 110.262 -170.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -106.75 -174.24 2.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.011 169.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 t -106.17 -164.24 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.342 -169.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -104.32 127.66 52.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.397 -168.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.401 ' O ' HG23 ' A' ' 74' ' ' THR . 14.2 t 58.33 91.16 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.234 174.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -80.64 -172.45 3.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.346 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 76' ' ' LYS . 1.4 mmmm . . . . . 0 C--O 1.241 0.607 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.325 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.466 0.525 . . . . 0.0 113.466 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -122.23 157.61 31.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.469 -175.006 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -84.92 119.92 73.14 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.246 -161.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -61.55 -25.02 78.93 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.778 2.319 . . . . 0.0 113.236 169.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -75.43 -74.36 0.21 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.421 -176.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -91.67 -22.41 20.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.608 -166.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 72.72 51.92 0.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.575 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.52 -169.01 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.841 158.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.3 155.0 19.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.449 160.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 47.9 t -112.29 112.13 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.666 -165.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.19 164.34 26.18 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.273 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.35 -62.4 1.9 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 -159.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -12.94 61.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.712 -173.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -101.22 44.55 1.01 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.093 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.54 144.57 40.55 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.483 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.12 119.65 5.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.606 154.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 95.9 m -99.97 141.49 32.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.365 -163.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.659 ' OG ' HD13 ' A' ' 19' ' ' LEU . 28.5 t -170.13 133.87 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.275 -163.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 ' OG ' ' A' ' 18' ' ' SER . 6.8 mp 59.87 18.34 7.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.471 161.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.66 -24.2 8.1 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 164.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -140.05 158.17 44.48 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.218 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.6 m-20 -84.31 178.33 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.301 -165.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 48.9 m95 -147.91 -174.69 4.63 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 113.689 -1.596 . . . . 0.0 109.486 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.6 m80 -99.92 157.81 16.26 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.198 -1.364 . . . . 0.0 110.659 170.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.573 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 ttp180 -66.83 -60.03 6.93 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.817 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -60.39 -20.43 63.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.394 2.063 . . . . 0.0 113.723 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.56 -54.64 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.19 -169.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 37' ' ' LEU . 1.3 tp -65.05 84.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.327 -163.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.58 148.62 52.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 -170.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.6 t -64.76 127.79 33.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.392 172.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -95.8 34.22 1.55 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.049 171.454 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -56.2 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.426 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.5 p -104.67 -17.93 14.48 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.085 -174.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.05 39.88 44.42 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 174.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -118.79 138.07 52.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.991 -0.605 . . . . 0.0 110.449 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -68.39 159.99 30.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.382 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.5 mt -124.91 123.47 39.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.468 -170.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.62 -168.05 2.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.528 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.9 t -76.01 73.06 2.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.395 -168.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.61 55.36 0.95 Allowed Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 167.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.78 12.77 5.61 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 162.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.6 p80 -114.14 -168.6 1.38 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.24 -177.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.96 157.84 16.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.874 160.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.634 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -112.7 131.19 55.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.035 -161.102 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.458 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 58.0 t-80 -96.44 163.56 13.0 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.371 160.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.458 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 11.5 tp10 -60.79 92.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.108 -162.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 55.25 7.55 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.614 -170.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 176.28 102.98 0.1 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 121.447 0.642 . . . . 0.0 109.876 165.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 18.0 Cg_endo -65.28 149.82 88.03 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.714 2.276 . . . . 0.0 113.627 169.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 50.6 m-85 -143.44 -178.84 6.07 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.007 169.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.5 m -56.23 138.95 49.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 113.49 -1.686 . . . . 0.0 110.802 165.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.7 -31.72 70.99 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.036 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -161.37 162.38 21.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 CA-C-N 114.715 -1.129 . . . . 0.0 109.251 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -73.36 -13.27 19.53 Favored 'Cis proline' 0 N--CA 1.483 0.856 0 C-N-CA 122.65 -1.812 . . . . 0.0 113.609 -13.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 80.7 m -59.5 -42.01 91.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.72 -156.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -66.44 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.306 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -11.64 7.88 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.42 -169.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.86 -58.88 2.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.352 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -43.06 9.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.401 -169.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.455 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 10.7 m-85 -113.1 110.23 20.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.354 -179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 170.55 -58.01 0.19 Allowed Glycine 0 CA--C 1.544 1.85 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 172.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -52.95 -82.33 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.997 0 C-N-CA 122.481 2.121 . . . . 0.0 113.603 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.6 -77.35 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.356 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 108.4 0.01 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -61.17 -49.52 76.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.361 -0.419 . . . . 0.0 110.305 -170.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.08 105.02 0.1 OUTLIER Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -170.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.526 ' HB3' ' NH1' ' A' ' 67' ' ' ARG . 4.7 mtm105 -63.02 -30.39 71.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.346 -170.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.11 103.71 0.33 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -170.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 112.67 -149.26 18.43 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.485 -1.046 . . . . 0.0 110.485 170.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.72 103.24 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.252 -169.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -141.63 113.91 8.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.053 168.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.93 -62.7 1.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.382 -169.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 m80 -61.06 169.03 2.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.401 -170.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.5 p -117.54 87.33 2.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.433 170.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 68.2 -79.09 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.364 169.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.502 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.432 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.46 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 12.2 Cg_endo . . . . . 0 N--CA 1.485 1.025 0 N-CA-C 113.612 0.581 . . . . 0.0 113.612 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -142.28 151.16 41.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.5 172.07 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.9 t -88.01 117.74 68.8 Favored Pre-proline 0 C--O 1.251 1.155 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.253 -162.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -59.72 -22.1 66.09 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.732 2.288 . . . . 0.0 113.171 169.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -74.09 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.441 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.61 -21.26 19.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.61 -164.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.43 58.58 0.13 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.452 -170.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.15 -168.56 1.54 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.01 160.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.8 mt-10 -105.76 152.57 23.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.63 161.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -112.44 113.09 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.595 -162.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -72.84 156.27 39.06 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.371 177.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -60.35 -62.3 1.97 Allowed 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.839 -159.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -1.4 10.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.736 -173.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -102.57 14.46 31.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.422 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.96 152.86 18.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.306 -161.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.634 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.5 153.56 13.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.65 156.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.33 142.69 35.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.767 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.457 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 38.7 t -177.46 133.35 0.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.284 172.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.523 ' HB3' ' HZ2' ' A' ' 21' ' ' LYS . 3.3 mm? 59.96 32.21 21.03 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.537 -172.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.86 18.34 68.43 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 167.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HZ2' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -140.4 155.11 46.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 165.339 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.46 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.6 m-20 -86.6 176.99 7.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.305 -164.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -149.27 -175.49 5.0 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.196 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.3 m80 -100.6 140.61 34.62 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.527 169.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.685 HH12 HG21 ' A' ' 36' ' ' THR . 17.3 tpt85 -62.02 -46.52 91.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 115.206 -0.907 . . . . 0.0 109.871 -173.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.0 Cg_exo -50.01 -39.62 50.17 Favored 'Trans proline' 0 N--CA 1.484 0.967 0 C-N-CA 122.724 2.283 . . . . 0.0 113.418 169.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.81 -47.62 37.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.268 -164.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.767 HD21 ' CE1' ' A' ' 42' ' ' HIS . 4.1 tp -66.16 77.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.488 -170.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 29' ' ' LYS . 15.5 ptmt -138.31 141.42 39.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.393 -171.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.5 t -60.26 122.01 13.43 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 172.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 20.0 mt-10 -96.88 38.59 1.22 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.166 167.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -39.1 0.76 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.382 -177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.8 p -120.6 -27.57 5.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.056 172.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.29 47.15 5.58 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.534 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -104.25 130.58 52.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.416 167.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.685 HG21 HH12 ' A' ' 25' ' ' ARG . 85.9 m -64.39 146.83 53.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.373 167.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.0 mt -114.89 131.03 56.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.401 -167.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -78.98 -167.86 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.482 168.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -65.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.453 -168.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -127.49 56.9 0.72 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.72 10.3 3.7 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 114.997 -0.602 . . . . 0.0 111.89 166.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.767 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.1 p-80 -108.75 -170.16 1.62 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 111.026 -175.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.418 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -146.57 -163.21 1.7 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.845 168.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -171.12 132.83 0.84 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.302 174.703 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.476 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 64.3 t60 -95.24 159.3 15.08 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 154.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.68 90.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.018 -161.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.87 -44.09 1.21 Allowed Glycine 0 CA--C 1.53 1.004 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.733 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 7.2 mtmm -132.28 108.53 13.63 Favored Pre-proline 0 C--O 1.243 0.74 0 CA-C-O 121.139 0.495 . . . . 0.0 109.81 -159.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 16.1 Cg_endo -67.75 155.87 68.22 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 123.115 2.543 . . . . 0.0 113.648 165.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.3 m-85 -152.62 -162.16 1.44 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.858 169.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.3 m -57.45 139.09 54.16 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.316 162.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.61 -34.67 74.56 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.103 164.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 50.3 m80 -158.56 173.1 5.31 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.386 164.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.527 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.1 Cg_endo -63.23 -18.95 5.13 Favored 'Cis proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.466 -2.306 . . . . 0.0 112.603 -22.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.4 m -57.33 -40.36 77.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.219 -154.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -60.93 -48.31 82.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.309 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.1 t -65.52 -18.31 65.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.644 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.46 -53.69 5.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.126 -165.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.09 -30.75 7.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.394 -171.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 11.3 m-85 -103.88 -173.8 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.226 166.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 139.2 140.46 3.95 Favored Glycine 0 CA--C 1.544 1.847 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 173.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -58.04 131.17 41.93 Favored 'Trans proline' 0 N--CA 1.486 1.053 0 C-N-CA 122.479 2.119 . . . . 0.0 113.558 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.496 ' HD3' ' H ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -61.18 -17.51 53.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.384 -171.169 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -162.34 -84.24 0.05 OUTLIER Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 169.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.34 -42.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.293 169.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -117.85 -71.86 0.42 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 169.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.482 ' CZ ' ' HB2' ' A' ' 67' ' ' ARG . 2.7 ptm85 -178.7 156.0 0.85 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.408 -0.396 . . . . 0.0 110.444 169.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.64 -69.6 1.29 Allowed Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 157.28 -175.07 34.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -170.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.96 -40.78 12.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.429 -0.386 . . . . 0.0 110.267 -169.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 107.18 18.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.966 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.98 98.63 1.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.456 169.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -93.04 -170.96 2.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.291 169.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.2 m -63.71 -34.69 78.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.369 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -170.16 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.389 169.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.365 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HD2' ' HE3' ' A' ' 21' ' ' LYS . 3.1 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.545 0.556 . . . . 0.0 113.545 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HG2' ' N ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -119.39 142.87 47.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.339 -169.198 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.9 t -78.72 118.68 73.81 Favored Pre-proline 0 C--O 1.252 1.207 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.47 -162.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -61.8 -12.0 23.43 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 123.011 2.474 . . . . 0.0 113.479 170.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.576 ' HD2' ' HD2' ' A' ' 49' ' ' PRO . 3.7 ttpp -93.52 -77.08 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.58 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.8 p -88.5 -19.47 26.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.985 -163.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.72 56.16 0.18 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.497 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.05 -172.57 2.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.013 161.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -97.55 152.78 18.67 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.68 166.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -116.34 111.71 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.549 -163.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.7 158.56 31.99 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.367 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.36 -65.86 0.62 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.803 -159.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -12.51 61.62 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.701 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.97 46.72 0.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.95 168.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.7 ptt85 -118.56 149.91 40.55 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.77 170.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 28' ' ' LEU . 19.3 m -138.62 149.25 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.554 157.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -114.06 136.99 52.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.475 -163.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 24.3 t -178.23 135.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.393 -170.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.98 17.91 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.717 -176.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.36 -24.89 30.38 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 166.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' HD2' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -114.98 164.9 13.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.843 -0.679 . . . . 0.0 110.07 179.208 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 3.8 m-20 -90.8 177.44 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.283 -165.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.0 m95 -153.03 173.72 15.07 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 113.907 -1.497 . . . . 0.0 108.99 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.7 m80 -92.08 142.65 27.28 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.466 174.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.18 -49.87 86.49 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.793 -172.415 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.6 Cg_endo -58.29 -41.02 70.66 Favored 'Trans proline' 0 N--CA 1.484 0.915 0 C-N-CA 122.551 2.168 . . . . 0.0 113.613 172.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.535 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.5 m -61.1 -48.13 83.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.213 -171.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.776 HD22 HG21 ' A' ' 16' ' ' VAL . 4.2 tp -67.71 94.3 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.379 -167.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.449 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.7 ttmt -153.16 149.46 28.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.471 -171.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -73.24 122.72 22.39 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.372 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -97.78 42.03 1.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.042 167.451 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 13.3 tptp -132.3 -49.87 0.93 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.328 172.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -109.26 -31.35 7.6 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.763 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.17 49.16 5.39 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -104.04 132.47 50.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.405 -0.397 . . . . 0.0 110.346 161.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.414 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 9.2 m -60.56 136.97 58.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.345 166.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 39.8 mt -97.89 169.66 9.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.315 -163.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.5 -174.97 2.66 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.355 -161.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -72.83 67.89 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.316 165.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.94 53.62 2.81 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 172.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.39 12.24 8.45 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 160.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.624 ' NE2' HD11 ' A' ' 28' ' ' LEU . 24.4 p-80 -110.62 -169.61 1.49 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 114.911 -0.644 . . . . 0.0 110.469 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.425 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.55 -163.28 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.72 165.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.4 pp20? -155.32 139.29 16.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.189 169.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -124.59 104.32 8.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.058 172.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 58.59 43.35 19.23 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 99.84 -20.16 50.37 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 168.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.71 99.73 14.36 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.412 0.625 . . . . 0.0 109.867 -167.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.576 ' HD2' ' HD2' ' A' ' 5' ' ' LYS . 9.7 Cg_endo -66.1 153.9 76.25 Favored 'Trans proline' 0 N--CA 1.484 0.948 0 C-N-CA 122.429 2.086 . . . . 0.0 113.602 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 38.3 m-85 -151.46 -165.75 2.33 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.04 167.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.6 m -57.61 132.26 52.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.99 -1.459 . . . . 0.0 110.395 165.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.86 -36.27 78.74 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.917 162.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 60.4 m80 -152.8 168.49 11.32 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.134 161.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 20.1 Cg_endo -67.57 -22.79 7.88 Favored 'Cis proline' 0 N--CA 1.489 1.232 0 C-N-CA 122.43 -1.904 . . . . 0.0 112.838 -17.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.4 m -56.96 -41.2 77.9 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.286 -153.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.39 -61.39 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.368 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.38 23.96 3.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.516 -166.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -121.44 -45.76 2.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.354 172.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.415 ' HA ' ' CE ' ' A' ' 59' ' ' MET . 24.1 mmt -106.2 -31.33 8.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.42 -169.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.2 93.04 8.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.356 -167.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.34 -65.39 0.01 OUTLIER Glycine 0 CA--C 1.543 1.798 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 171.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -56.77 -154.84 0.01 OUTLIER 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.471 2.114 . . . . 0.0 113.421 168.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -179.15 131.93 0.11 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.387 168.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 132.86 125.68 2.65 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 83.59 1.23 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.391 . . . . 0.0 110.325 169.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -178.86 -104.16 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -170.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -159.65 157.28 29.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.425 -170.303 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 131.52 5.72 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 65.17 100.68 0.01 OUTLIER Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.9 32.99 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.431 -0.385 . . . . 0.0 110.264 -169.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -96.26 166.58 11.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.087 168.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.75 -82.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.373 -169.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -99.72 135.66 40.8 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.405 -170.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 17.0 p 60.69 -172.96 0.13 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.825 176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -133.72 -80.48 0.47 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.341 -170.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 tptm . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.343 -170.033 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.575 ' H2 ' ' HE2' ' A' ' 2' ' ' LYS . 1.1 Cg_endo . . . . . 0 N--CA 1.487 1.12 0 N-CA-C 113.5 0.539 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.575 ' HE2' ' H2 ' ' A' ' 1' ' ' PRO . 3.4 mmtt -130.72 139.48 50.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.378 172.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 28.7 t -82.92 122.84 78.19 Favored Pre-proline 0 C--O 1.25 1.097 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.178 -162.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -62.63 -30.97 79.54 Favored 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.99 2.46 . . . . 0.0 113.23 169.015 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -71.08 0.23 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.394 -176.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.9 -22.75 16.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.601 -164.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 72.4 68.37 0.13 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.456 -168.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 -168.23 1.91 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.208 162.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.69 151.41 23.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.341 164.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 62.9 t -120.41 111.25 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.846 -162.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.0 163.6 25.74 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.431 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.57 -59.44 5.4 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.887 -160.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.641 -176.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.644 ' O ' HG13 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -108.03 37.87 2.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.058 166.314 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.801 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -118.69 131.84 56.15 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.943 163.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 28' ' ' LEU . 19.9 m -112.04 167.62 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.508 156.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 m -126.58 138.03 53.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.546 -167.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 35.6 t -177.42 137.5 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.395 -177.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.516 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 60.01 17.94 7.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.689 -177.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.13 -24.95 29.48 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.569 -1.013 . . . . 0.0 110.569 166.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.0 160.84 19.11 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 114.883 -0.658 . . . . 0.0 110.129 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.4 m-20 -88.42 177.03 6.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.271 -165.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -150.15 163.14 38.98 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.067 -1.424 . . . . 0.0 109.362 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -82.88 138.45 33.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.347 170.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.91 -46.69 96.81 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.779 -169.083 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_exo -54.59 -43.8 55.59 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 122.697 2.265 . . . . 0.0 113.537 169.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.83 -49.81 74.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.306 -169.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.539 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -68.16 88.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.376 -168.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.3 142.47 27.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.333 -169.987 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -60.12 122.13 13.65 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.466 171.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.578 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 27.1 mt-10 -96.32 38.23 1.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.964 165.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.79 -50.84 1.24 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.046 175.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.9 p -112.08 -20.42 11.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.874 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.8 44.4 20.03 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -100.58 127.18 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.335 169.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 72.0 m -61.44 139.8 58.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.412 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 42' ' ' HIS . 77.9 mt -104.32 116.55 32.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.292 -169.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -118.57 -171.23 2.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.531 -172.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 t 57.83 -90.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.098 163.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.36 43.15 0.07 OUTLIER Glycine 0 CA--C 1.533 1.18 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 161.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.7 24.24 15.62 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -167.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 37' ' ' LEU . 36.1 p-80 -101.16 -169.41 1.69 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.597 -0.802 . . . . 0.0 110.52 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.38 158.32 7.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.816 162.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp20? -115.05 133.65 55.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.025 -159.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.49 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 69.2 t60 -102.7 162.64 12.76 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 157.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.437 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 3.9 mm-40 -60.67 90.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.169 -161.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.77 -19.08 12.56 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.757 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -141.1 105.37 6.13 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-O 121.254 0.55 . . . . 0.0 109.773 -162.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.6 Cg_endo -66.43 161.08 42.54 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.872 2.381 . . . . 0.0 113.62 165.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -159.14 -171.18 3.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.0 173.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.5 m -58.08 139.54 54.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 113.666 -1.606 . . . . 0.0 110.321 165.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -60.36 -35.44 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.261 164.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.409 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 32.7 m80 -156.35 171.3 7.54 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.378 167.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 25.2 Cg_endo -62.65 -18.11 4.64 Favored 'Cis proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.135 -2.444 . . . . 0.0 112.539 -24.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.2 m -57.61 -41.74 81.86 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.129 -154.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -61.06 -60.02 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.294 174.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.409 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -70.97 -11.4 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.433 -168.577 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.59 -53.16 6.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.372 177.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.96 -37.61 9.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.417 -168.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 11.8 m-85 -121.71 78.03 1.41 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.392 -172.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.28 69.08 0.01 OUTLIER Glycine 0 CA--C 1.544 1.862 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -174.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -57.12 -16.69 22.3 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.524 2.15 . . . . 0.0 113.425 168.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -105.59 -174.68 2.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.363 -169.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.66 143.21 14.81 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 65' ' ' PHE . 0.3 OUTLIER -113.41 19.45 16.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.997 0.427 . . . . 0.0 110.394 -169.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -85.53 115.46 4.16 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -171.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -131.13 105.02 7.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.281 -0.46 . . . . 0.0 110.296 170.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -147.19 -75.77 0.02 OUTLIER Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 66.5 79.63 0.2 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.49 81.09 1.49 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.515 . . . . 0.0 110.331 -176.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -170.93 46.39 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.012 -168.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.93 -32.18 71.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.389 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.98 -170.16 1.61 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.336 -169.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.0 m 69.75 135.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.498 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -119.55 -171.85 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.291 -169.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.361 170.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.484 0.97 0 N-CA-C 113.571 0.566 . . . . 0.0 113.571 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -123.88 146.98 48.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.466 -169.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.2 t -83.41 117.0 67.36 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.275 -165.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.608 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.63 -22.08 73.57 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.786 2.324 . . . . 0.0 113.238 169.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.44 -73.57 0.27 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.451 -175.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -92.11 -22.54 19.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.526 -167.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t0 72.99 60.48 0.1 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.555 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.45 -169.23 1.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.068 159.316 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.76 153.1 18.49 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.477 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.7 t -112.71 112.98 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.573 -167.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -69.0 152.69 44.93 Favored 'General case' 0 C--N 1.335 -0.065 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.212 175.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -59.97 4.55 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.712 -158.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.86 -0.29 10.92 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.581 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.42 15.49 28.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.336 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -96.89 153.41 17.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.248 -161.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.61 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -146.2 149.16 16.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.692 157.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.72 136.82 48.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.753 -169.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.444 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.45 138.77 0.23 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.31 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.46 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 59.98 23.95 13.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.663 -176.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.16 -24.78 28.6 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 166.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -115.43 163.5 15.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.793 -0.704 . . . . 0.0 110.247 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.466 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.73 176.02 7.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.418 -168.537 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.608 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 32.2 m95 -147.28 -177.54 5.74 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.115 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -102.42 141.06 35.85 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.521 169.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.563 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 11.5 mtm180 -60.88 -50.84 83.21 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.896 -171.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 7.0 Cg_exo -50.54 -36.83 50.86 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.386 2.057 . . . . 0.0 113.521 171.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.34 -52.28 23.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.372 -168.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 42' ' ' HIS . 3.9 tp -64.4 92.23 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.374 -167.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.452 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 pttp -150.15 147.97 28.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.455 -170.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -64.65 121.42 14.44 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.29 171.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.474 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -95.36 44.91 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.033 163.562 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.477 ' NZ ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -137.18 -45.26 0.56 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.352 175.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.6 p -115.62 -33.53 5.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.924 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.45 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 81.67 50.15 5.11 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.72 129.1 55.92 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.248 158.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.8 m -61.3 136.95 58.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.286 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 14.9 mt -92.09 134.61 34.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.351 -161.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.71 HG22 ' OG ' ' A' ' 39' ' ' SER . 80.2 m -97.37 146.36 25.25 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.937 175.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.71 ' OG ' HG22 ' A' ' 38' ' ' THR . 28.3 m 61.24 -156.14 0.35 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.952 159.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -89.99 54.92 3.67 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 156.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -105.45 14.08 47.12 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.789 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.8 p80 -113.1 -167.39 1.18 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-N 113.927 -1.137 . . . . 0.0 110.469 173.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.89 159.87 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.301 160.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.449 ' CG ' ' HG ' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -126.1 122.65 36.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.069 -165.101 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 -92.65 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.935 161.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.46 42.25 21.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.832 170.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 23.59 61.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -119.54 84.78 30.72 Favored Pre-proline 0 CA--C 1.541 0.621 0 CA-C-O 121.547 0.689 . . . . 0.0 109.825 176.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.409 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 11.1 Cg_endo -63.61 148.74 92.15 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.511 2.141 . . . . 0.0 113.761 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 52.2 m-85 -154.49 -167.37 2.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.971 171.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.1 m -57.12 133.44 55.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 113.496 -1.684 . . . . 0.0 110.499 163.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -60.97 -25.5 66.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.003 162.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.494 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 21.7 m80 -166.63 162.69 11.41 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.356 169.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -71.28 -13.83 15.24 Favored 'Cis proline' 0 N--CA 1.482 0.831 0 C-N-CA 122.5 -1.875 . . . . 0.0 113.509 -15.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.0 m -59.7 -43.41 94.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.65 -156.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -60.9 -54.43 45.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.494 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.494 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -77.72 -16.01 58.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.358 -167.462 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.77 -46.58 10.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.258 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.477 ' HG3' ' NZ ' ' A' ' 32' ' ' LYS . 3.9 mmm -106.69 -34.94 7.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.39 -169.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.34 101.45 10.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.301 -167.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.94 77.3 0.03 OUTLIER Glycine 0 CA--C 1.543 1.805 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 171.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -55.94 -11.43 5.47 Favored 'Trans proline' 0 N--CA 1.487 1.137 0 C-N-CA 122.454 2.103 . . . . 0.0 113.323 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 64.05 98.65 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.448 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.89 116.19 0.4 Allowed Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -170.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -63.62 -170.12 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.381 -0.409 . . . . 0.0 110.357 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.95 129.49 46.51 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -169.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 170.38 1.61 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.393 -169.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.97 -64.21 0.26 Allowed Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.454 -1.059 . . . . 0.0 110.454 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 60.95 82.91 0.07 OUTLIER Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 170.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -149.16 -162.1 1.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.158 0.504 . . . . 0.0 110.307 -169.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 58.79 -84.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.692 -167.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.7 m 65.8 -74.96 0.05 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.443 -168.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -61.15 130.7 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.443 -170.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.88 88.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.404 170.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 75' ' ' PHE . 1.5 p90 -130.62 117.91 20.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.356 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.241 0.638 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.375 -170.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.442 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 20.9 Cg_exo . . . . . 0 N--CA 1.486 1.034 0 N-CA-C 113.615 0.583 . . . . 0.0 113.615 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.95 160.03 27.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.416 -167.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -85.92 121.11 73.07 Favored Pre-proline 0 C--O 1.251 1.148 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.096 -164.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.579 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -61.25 -28.9 85.52 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 C-N-CA 122.724 2.283 . . . . 0.0 113.163 169.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -70.07 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.426 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.45 -22.13 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.619 -166.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 72.59 54.45 0.15 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.475 -171.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -168.71 1.36 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 159.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 152.88 23.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.583 161.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -112.7 112.32 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.54 -162.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -75.54 159.76 30.91 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.361 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -60.45 -62.42 1.87 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.778 -159.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.58 11.11 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.688 -173.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -101.99 13.75 33.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.505 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -97.04 151.07 20.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.36 -160.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.37 156.2 15.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.736 156.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.93 137.13 52.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.667 -169.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.436 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 42.4 t -174.14 136.82 0.52 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.271 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.99 18.75 7.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.618 -172.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.58 28.37 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.39 155.24 19.31 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 114.89 -0.655 . . . . 0.0 110.184 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.442 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.2 m-20 -88.5 177.19 6.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.323 -166.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 26.6 m95 -149.17 -175.74 5.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.153 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -98.67 145.55 26.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.463 168.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.553 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.74 -44.86 96.46 Favored Pre-proline 0 CA--C 1.545 0.774 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.838 -166.445 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -64.71 -35.58 45.65 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.532 2.155 . . . . 0.0 113.547 173.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.22 -44.35 84.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.339 -163.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.546 HD12 ' HG3' ' A' ' 49' ' ' PRO . 3.8 tp -60.73 82.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.354 -174.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.57 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 10.7 ttmt -148.58 144.88 27.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.14 -0.937 . . . . 0.0 110.331 -162.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -65.02 126.17 27.2 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.536 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -96.88 27.37 4.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.065 166.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.44 -35.78 2.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.279 -175.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -126.09 -25.98 3.47 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.062 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.58 49.47 6.62 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -175.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.03 124.2 45.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.317 164.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.57 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 95.4 m -61.18 135.09 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.164 167.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.693 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.4 mt -100.58 139.47 36.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.392 -164.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 73.5 m -60.62 154.35 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.184 163.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.6 t -66.29 62.69 0.04 OUTLIER 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.486 160.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 146.95 144.74 4.08 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.371 -162.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.91 13.53 83.55 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 119.853 -1.165 . . . . 0.0 111.483 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.693 ' HB2' HD13 ' A' ' 37' ' ' LEU . 50.1 p-80 -112.22 -170.0 1.58 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 114.667 -0.767 . . . . 0.0 110.813 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -152.04 -162.77 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.604 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.592 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.5 tt0 -170.02 138.1 1.68 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.183 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.51 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 9.8 p80 -96.49 173.03 7.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.775 157.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 89.01 0.21 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.083 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.07 -65.95 0.33 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -168.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -152.61 144.78 16.79 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-O 121.521 0.677 . . . . 0.0 109.96 -162.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.592 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.4 Cg_endo -72.73 171.26 17.65 Favored 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.834 2.356 . . . . 0.0 113.62 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 29.5 m-85 -155.94 -164.55 1.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.241 165.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.4 m -57.91 135.68 56.93 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.258 162.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -60.85 -34.52 74.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.054 162.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.456 ' CD2' ' CB ' ' A' ' 57' ' ' SER . 64.2 m80 -157.6 164.25 22.11 Favored Pre-proline 0 CA--C 1.552 1.03 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.335 166.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.47 -15.69 16.93 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.584 -1.84 . . . . 0.0 113.534 -14.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.0 m -59.57 -41.91 91.28 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.826 -156.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.477 ' CE2' ' CE2' ' A' ' 60' ' ' PHE . 9.6 t80 -61.18 -56.94 14.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.452 172.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.456 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 16.7 t -62.99 -20.51 65.35 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.372 -171.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.02 -47.22 5.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.184 -166.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.9 mmm -98.68 -20.03 17.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.382 -163.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 0.6 OUTLIER -61.05 99.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.351 -163.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.51 -137.37 2.69 Favored Glycine 0 CA--C 1.545 1.924 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 167.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -57.97 -59.72 0.5 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 C-N-CA 122.483 2.122 . . . . 0.0 113.378 166.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.83 -49.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.263 167.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.7 -172.27 6.52 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 167.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -141.41 -52.22 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.27 -170.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -104.97 176.07 22.57 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -85.41 144.9 27.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.391 -0.404 . . . . 0.0 110.364 -169.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -119.49 -67.3 0.3 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 170.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 61.79 97.39 0.01 OUTLIER Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 170.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -175.53 143.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.439 -0.381 . . . . 0.0 110.279 169.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 58.4 102.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.67 167.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.2 t -177.02 98.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.398 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.545 ' O ' ' CD2' ' A' ' 73' ' ' HIS . 38.1 p-80 58.36 95.98 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.682 171.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -63.83 -160.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.428 170.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -61.03 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.387 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 76' ' ' LYS . 6.4 tptp . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.401 -170.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.402 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 10.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.64 0.592 . . . . 0.0 113.64 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 147.36 41.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.405 -170.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.6 t -85.64 118.94 71.57 Favored Pre-proline 0 C--O 1.25 1.13 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.178 -164.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.574 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.0 Cg_endo -59.49 -27.51 85.14 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 122.518 2.145 . . . . 0.0 113.131 169.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -72.63 -70.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.448 -174.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -96.78 -21.92 17.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.626 -165.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 72.33 53.18 0.17 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.544 -173.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -112.72 -169.06 1.41 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.944 159.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -101.98 151.01 22.63 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.596 163.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 46.8 t -110.55 110.69 33.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.616 -167.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.43 161.67 29.03 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.385 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -60.15 -62.3 1.97 Allowed 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -158.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.14 60.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.731 -175.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -104.39 49.26 0.82 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.861 167.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 143.13 45.85 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.504 -1.225 . . . . 0.0 110.601 170.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 m -132.5 117.93 33.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.442 152.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.1 m -97.75 142.43 29.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.402 -173.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.1 t -177.72 137.27 0.2 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.089 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.843 HD23 ' OE2' ' A' ' 44' ' ' GLU . 4.6 mp 60.27 16.88 6.52 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.431 -1.258 . . . . 0.0 110.603 -172.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.99 -25.63 24.74 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 164.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -117.17 149.67 39.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.807 -0.696 . . . . 0.0 110.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -85.7 177.69 7.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.193 -165.298 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.574 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.2 m95 -151.49 -176.59 5.65 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.483 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.2 m80 -97.71 150.21 21.45 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.59 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.7 ttt180 -61.3 -48.87 90.14 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.83 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 3.9 Cg_exo -66.85 -26.27 44.75 Favored 'Trans proline' 0 N--CA 1.484 0.931 0 C-N-CA 122.502 2.134 . . . . 0.0 113.569 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.55 -51.97 10.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.228 -164.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.567 HD12 ' CD2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -61.92 91.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.403 -160.844 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.517 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 mtpp -145.76 153.39 40.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.327 -172.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -65.23 122.42 17.07 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.242 163.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -96.0 28.53 3.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.117 169.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -50.42 2.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.074 177.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.9 p -112.26 -20.25 11.93 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.916 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.46 40.12 20.01 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 126.36 41.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.435 -0.383 . . . . 0.0 110.326 167.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.4 m -61.08 137.21 58.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.27 168.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 46.1 mt -99.64 161.24 13.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -164.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -98.73 -163.53 1.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.229 -166.227 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.567 ' H ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -93.49 20.86 6.78 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.471 -177.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.22 55.34 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.34 12.77 4.34 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 170.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 12.6 p80 -106.73 -168.94 1.48 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.707 -0.747 . . . . 0.0 110.745 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -150.61 -169.97 3.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.991 165.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.843 ' OE2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -132.21 141.24 48.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.124 170.775 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.6 t60 -139.92 101.54 4.2 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.846 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 58.62 46.42 14.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.627 -169.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 63.54 19.36 62.4 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.611 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.92 98.5 42.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 121.199 0.523 . . . . 0.0 109.73 169.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 11.3 Cg_endo -54.94 141.37 78.42 Favored 'Trans proline' 0 N--CA 1.487 1.088 0 C-N-CA 122.055 1.837 . . . . 0.0 113.446 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 97.5 m-85 -150.49 -179.23 7.05 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.106 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.8 m -56.72 131.16 48.34 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.472 165.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.97 -33.64 73.52 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.886 161.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.555 ' CD2' ' HB3' ' A' ' 57' ' ' SER . 65.3 m80 -155.94 164.83 20.01 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.258 163.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.8 Cg_endo -73.06 -16.82 17.48 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.696 -1.793 . . . . 0.0 113.616 -13.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.7 m -59.59 -43.92 93.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.778 -156.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -61.11 -55.34 33.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.316 177.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.555 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 29.6 t -80.94 -16.79 52.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.469 -165.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.82 -40.52 17.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.309 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 31.7 mmm -78.23 -48.35 15.96 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.413 -178.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 80.9 m-85 -98.19 87.39 3.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.427 -168.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 177.97 76.78 0.06 OUTLIER Glycine 0 CA--C 1.544 1.859 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -172.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -62.27 -85.57 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.644 2.23 . . . . 0.0 113.504 -169.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.03 120.06 24.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.26 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.78 -173.26 6.0 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.69 -65.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.413 -0.394 . . . . 0.0 110.434 169.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 94.16 -95.48 1.93 Allowed Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 -175.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -87.32 116.35 25.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.381 -170.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 148.97 58.27 0.01 OUTLIER Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -170.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -152.69 -130.82 1.59 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.49 133.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.137 -0.531 . . . . 0.0 110.414 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -133.43 -74.3 0.49 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.026 -169.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.0 p -113.53 -164.93 0.96 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.406 -169.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 71.63 25.91 3.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.345 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.53 69.34 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.414 169.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 66.62 176.38 0.23 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.407 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.62 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.437 169.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.419 ' H2 ' ' H ' ' A' ' 2' ' ' LYS . 3.6 Cg_endo . . . . . 0 N--CA 1.484 0.931 0 N-CA-C 113.568 0.564 . . . . 0.0 113.568 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.419 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -138.17 139.95 39.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.443 170.751 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.1 t -86.07 115.64 62.68 Favored Pre-proline 0 C--O 1.25 1.114 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.258 -164.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.573 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -60.05 -16.79 41.34 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 C-N-CA 122.771 2.314 . . . . 0.0 113.313 170.113 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -69.21 0.67 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.52 -171.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -94.21 -21.44 19.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.608 -170.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.34 52.1 0.18 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.496 -171.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.06 -168.49 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.856 160.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -106.51 152.08 24.15 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.606 161.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -111.65 111.85 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.653 -164.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.483 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 6.2 t80 -75.46 157.84 33.47 Favored 'General case' 0 N--CA 1.458 -0.054 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.311 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -59.78 -62.1 2.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 -157.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.55 -11.32 60.86 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.671 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.483 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.2 pt-20 -102.73 42.97 1.1 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.17 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.89 149.87 29.25 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.454 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.3 m -141.44 148.63 20.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.627 155.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.55 137.61 50.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.657 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 15.8 t -176.33 128.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.336 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 59.93 35.37 21.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.605 -170.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.82 18.04 52.13 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HG2' ' N ' ' A' ' 22' ' ' ASP . 20.7 ttmt -137.11 153.61 50.48 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 164.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 m-20 -88.68 177.08 6.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.392 -165.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.573 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 23.4 m95 -151.15 -173.25 4.44 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.954 -177.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -102.94 146.03 28.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 113.894 -1.503 . . . . 0.0 110.54 169.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.6 OUTLIER -60.91 -50.13 86.23 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.862 -169.204 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 6.5 Cg_exo -62.42 -34.8 75.44 Favored 'Trans proline' 0 N--CA 1.484 0.933 0 C-N-CA 122.549 2.166 . . . . 0.0 113.49 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.77 -52.9 58.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.232 -167.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.866 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.1 tp -60.42 93.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.253 -164.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.543 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.1 mttp -148.15 139.1 23.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.356 -164.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.2 t -65.66 120.81 13.63 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.354 166.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 5.7 pt-20 -98.69 39.74 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.755 167.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' A' ' 59' ' ' MET . 0.1 OUTLIER -132.18 -39.32 1.06 Allowed 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.288 179.238 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -119.89 -22.2 6.87 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.12 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.99 41.44 12.32 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -95.19 122.55 37.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.49 -0.355 . . . . 0.0 110.372 167.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 90.8 m -61.09 135.62 57.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.317 170.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.733 ' O ' HD23 ' A' ' 28' ' ' LEU . 87.1 mt -101.7 97.83 8.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.314 -167.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.4 t -60.05 -160.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.352 161.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -68.94 0.2 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.611 170.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.91 -161.99 9.8 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 154.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.53 69.16 0.36 Allowed Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 165.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.866 ' CE1' HD21 ' A' ' 28' ' ' LEU . 48.7 p-80 -90.77 -170.83 2.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.912 -0.644 . . . . 0.0 110.951 169.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.422 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -165.28 -168.9 1.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.196 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.9 pp20? -152.88 139.7 19.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.057 -169.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -137.25 106.61 6.08 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.856 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.38 33.19 22.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.906 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.46 -27.57 10.48 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 166.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 103.01 20.55 Favored Pre-proline 0 C--O 1.244 0.771 0 CA-C-O 121.328 0.585 . . . . 0.0 109.845 -170.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.57 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.7 Cg_endo -63.75 147.81 92.33 Favored 'Trans proline' 0 N--CA 1.484 0.923 0 C-N-CA 122.485 2.123 . . . . 0.0 113.669 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 4.3 m-85 -139.89 -165.27 1.86 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.78 164.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.9 m -57.56 135.11 56.63 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.099 159.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.433 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 13.6 t-20 -62.81 -33.0 74.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.927 161.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.443 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 21.6 m-70 -157.29 162.41 27.5 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.408 169.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -71.54 -14.9 15.59 Favored 'Cis proline' 0 N--CA 1.482 0.826 0 C-N-CA 122.548 -1.855 . . . . 0.0 113.477 -14.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.3 m -59.84 -45.95 90.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.691 -156.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -60.84 -53.61 55.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.454 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.443 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.5 p -66.96 -28.71 68.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.334 -170.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.43 -46.93 15.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.302 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . 1.6 tpt -86.95 -40.28 14.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.545 -169.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.19 91.91 6.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.381 -169.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.76 87.07 1.98 Allowed Glycine 0 CA--C 1.544 1.855 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -56.55 107.88 0.3 Allowed 'Trans proline' 0 N--CA 1.488 1.173 0 C-N-CA 122.426 2.084 . . . . 0.0 113.293 167.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -70.48 81.42 0.57 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.448 -164.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 61.69 -165.03 19.93 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 169.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -169.55 80.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.491 -0.355 . . . . 0.0 110.123 166.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.31 155.48 39.74 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -166.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.89 -39.3 10.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.333 168.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 148.58 97.0 0.18 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 170.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -138.84 102.32 0.35 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.461 -1.055 . . . . 0.0 110.461 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -173.24 82.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.341 -0.43 . . . . 0.0 110.294 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -157.43 84.15 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.074 -168.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.8 t -88.52 158.04 18.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.353 -169.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -101.69 132.87 47.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.323 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.5 m -126.63 92.93 3.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.412 -170.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -116.07 19.38 15.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.48 169.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? . . . . . 0 C--O 1.24 0.582 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.439 -171.294 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.604 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 2.4 Cg_endo . . . . . 0 N--CA 1.487 1.106 0 N-CA-C 113.457 0.522 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.23 139.0 52.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.471 170.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.4 t -85.77 116.63 66.42 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.144 -165.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.616 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -60.33 -23.55 74.86 Favored 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 122.723 2.282 . . . . 0.0 113.283 169.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -70.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.466 -174.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -94.91 -22.08 18.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.658 -167.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.48 57.58 0.14 Allowed 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.521 -171.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -117.19 -168.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.919 160.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -104.42 153.61 20.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.688 162.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.913 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -113.04 114.21 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.537 -163.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -71.99 156.38 39.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.396 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -60.51 -62.26 1.99 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.837 -159.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.37 -1.17 9.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.688 -173.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.82 14.81 31.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.432 178.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.31 152.05 19.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.286 -161.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.491 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.73 150.12 16.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.646 155.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 m -113.58 135.14 54.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.803 -168.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.7 t -177.69 139.62 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.422 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.09 30.24 19.73 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.629 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.42 18.49 79.38 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 166.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -152.79 164.7 37.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.448 -0.376 . . . . 0.0 110.163 166.579 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 3.8 m-20 -90.65 176.79 6.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.392 -166.27 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.616 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.9 m95 -147.45 -176.71 5.35 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.166 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.913 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.3 m80 -101.36 142.62 32.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.499 168.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.72 -45.37 96.95 Favored Pre-proline 0 CA--C 1.543 0.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.819 -168.172 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 6.6 Cg_endo -62.96 -34.03 72.56 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.513 2.142 . . . . 0.0 113.647 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -67.48 -56.02 11.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.279 -166.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.769 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.1 tp -60.59 89.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.391 -164.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.54 146.32 29.4 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.418 -174.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.3 t -60.12 124.71 21.09 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.354 170.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 50' ' ' TYR . 1.3 tm-20 -96.34 20.1 10.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.133 169.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -105.32 -60.24 1.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.317 166.366 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.6 p -105.81 -21.54 13.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.825 -168.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.5 39.85 20.72 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.38 121.41 37.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.903 0.382 . . . . 0.0 110.194 166.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.99 132.51 54.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.288 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.596 HD13 ' HB2' ' A' ' 42' ' ' HIS . 60.7 mt -96.8 123.2 40.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.314 -168.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.532 HG23 ' N ' ' A' ' 40' ' ' GLY . 4.7 t -60.11 -162.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.544 168.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -95.65 32.49 1.81 Allowed 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.522 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.532 ' N ' HG23 ' A' ' 38' ' ' THR . . . -168.0 143.83 8.45 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -170.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.85 13.84 83.2 Favored Glycine 0 N--CA 1.468 0.787 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.284 163.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.769 ' CE1' HD11 ' A' ' 28' ' ' LEU . 10.1 p80 -106.1 -168.72 1.47 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.581 -0.81 . . . . 0.0 110.713 169.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.453 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -157.67 -177.4 6.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.244 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -168.8 124.6 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.881 -166.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.43 ' CD2' ' HZ ' ' A' ' 60' ' ' PHE . 56.5 t-80 -155.39 121.46 5.14 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.694 -179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.47 39.51 25.0 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.796 -176.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 -21.39 37.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm -98.18 102.81 15.05 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 121.826 0.822 . . . . 0.0 109.845 -168.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.549 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 13.5 Cg_endo -59.34 147.87 89.08 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.022 1.814 . . . . 0.0 113.372 168.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 9.8 m-85 -154.92 -166.75 2.39 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.241 169.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.2 m -57.63 135.37 56.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.372 163.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -60.62 -30.92 70.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.144 162.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.526 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 30.5 m-70 -162.63 164.9 16.06 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.369 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.447 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -71.68 -14.34 15.9 Favored 'Cis proline' 0 N--CA 1.482 0.82 0 C-N-CA 122.517 -1.868 . . . . 0.0 113.586 -14.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.1 m -59.85 -42.3 93.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -156.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.09 -39.58 90.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.376 176.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.526 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 24.7 p -76.12 -18.09 59.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -99.18 -43.42 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.206 -168.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.428 ' CG ' ' HD3' ' A' ' 32' ' ' LYS . 25.3 mtp -60.76 -45.2 95.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.47 171.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.43 ' HZ ' ' CD2' ' A' ' 45' ' ' HIS . 1.4 m-85 -68.88 85.81 0.33 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.342 -177.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.489 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 159.9 58.33 0.01 OUTLIER Glycine 0 CA--C 1.543 1.822 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 -170.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.489 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 8.1 Cg_exo -58.32 -76.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.485 1.028 0 C-N-CA 122.607 2.205 . . . . 0.0 113.498 -170.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? 63.75 85.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.285 -167.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.64 100.09 0.25 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -168.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 61.12 -169.98 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.329 -0.435 . . . . 0.0 110.325 169.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 159.66 -167.76 35.3 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 169.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.7 mmm-85 -128.95 117.68 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.257 -0.472 . . . . 0.0 110.396 170.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 172.53 -24.88 0.08 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 170.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 144.82 -81.23 0.22 Allowed Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 170.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.37 -175.85 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.324 -0.438 . . . . 0.0 110.336 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 58.97 -85.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.776 -167.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.4 p -171.58 -54.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.433 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.489 ' O ' HG22 ' A' ' 74' ' ' THR . 1.9 m-70 65.14 165.51 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.375 169.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 73' ' ' HIS . 4.5 t 60.44 28.61 18.27 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.873 175.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -120.16 149.64 41.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.4 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.549 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.397 170.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.45 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 1.5 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -134.67 156.7 48.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.424 170.835 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.8 t -81.39 119.26 75.21 Favored Pre-proline 0 C--O 1.25 1.111 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.346 -161.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.19 -19.03 61.85 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 C-N-CA 122.878 2.385 . . . . 0.0 113.233 167.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.67 -77.26 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.47 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -91.5 -19.56 22.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.903 -164.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.23 55.03 0.17 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.495 -173.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -114.74 -168.64 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.995 160.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 7.7 mt-10 -104.77 153.24 21.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.546 161.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.911 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -113.21 113.27 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.492 -163.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.38 157.15 37.48 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.42 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.39 -62.38 1.9 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 -159.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.54 -1.07 9.85 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.553 -173.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -102.81 14.21 32.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.442 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.52 152.52 18.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.266 -161.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.648 HG21 HD22 ' A' ' 28' ' ' LEU . 16.3 m -145.04 147.67 18.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.578 155.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.51 137.06 52.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.675 -168.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 10.5 t -178.08 130.01 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.297 -171.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.14 28.51 18.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.538 -171.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.01 18.05 70.38 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -138.68 155.1 48.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 164.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.45 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -88.9 177.03 6.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.375 -165.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.3 m95 -150.56 -176.74 5.61 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.102 -177.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.911 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -100.57 142.38 32.11 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.448 169.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.447 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 5.8 mtm180 -61.08 -46.31 96.24 Favored Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.781 -170.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 7.9 Cg_exo -60.84 -36.1 85.45 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.608 2.205 . . . . 0.0 113.535 174.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.44 -46.89 74.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.343 -168.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.726 HD21 ' CE1' ' A' ' 42' ' ' HIS . 7.6 tp -62.88 93.07 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.441 -166.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.49 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -149.31 142.48 25.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.778 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -60.01 124.42 20.15 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.551 174.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.35 23.88 5.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.215 171.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.457 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -113.16 -59.52 2.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.378 168.748 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.4 p -104.0 -16.15 15.4 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.863 -169.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 48.97 58.02 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -171.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -104.57 115.23 29.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.453 -0.373 . . . . 0.0 110.323 167.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.9 m -61.26 134.94 57.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.881 HD13 ' HB2' ' A' ' 42' ' ' HIS . 75.8 mt -97.46 125.81 42.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.425 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -71.6 -162.45 0.08 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.481 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.21 -15.29 32.78 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.605 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.642 ' H ' HG23 ' A' ' 38' ' ' THR . . . -159.25 -179.62 34.21 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -169.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.82 15.42 81.33 Favored Glycine 0 C--N 1.342 0.872 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.337 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.881 ' HB2' HD13 ' A' ' 37' ' ' LEU . 48.1 p-80 -109.71 -168.47 1.33 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 114.521 -0.84 . . . . 0.0 110.579 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -159.12 -169.11 2.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.332 170.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.487 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -150.77 131.69 14.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.989 -168.388 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.652 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 57.8 t-80 -135.62 100.45 4.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.994 176.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 58.6 43.89 18.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.832 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.09 -21.53 44.68 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -97.89 100.94 9.48 Favored Pre-proline 0 C--O 1.242 0.686 0 CA-C-O 121.283 0.563 . . . . 0.0 109.807 -172.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 10.4 Cg_endo -62.31 164.99 16.03 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.378 2.052 . . . . 0.0 113.737 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 71.9 m-85 -161.99 176.61 10.59 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.073 -171.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.8 m -57.86 128.41 36.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.961 -1.472 . . . . 0.0 110.054 160.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -60.86 -32.93 72.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.912 162.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 28.1 m80 -154.26 161.4 29.38 Favored Pre-proline 0 CA--C 1.551 1.018 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.154 163.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -74.39 -18.25 18.21 Favored 'Cis proline' 0 C--N 1.354 0.835 0 C-N-CA 122.718 -1.784 . . . . 0.0 113.61 -12.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -58.92 -45.34 90.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.89 -154.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -61.05 -61.89 2.25 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.0 p -72.68 -11.91 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.444 -173.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.89 -56.49 3.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.068 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HG3' ' HE2' ' A' ' 32' ' ' LYS . 3.6 tmm? -84.92 -39.42 18.2 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 113.584 -1.644 . . . . 0.0 109.939 -170.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.652 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 56.5 m-85 -87.55 -167.32 1.85 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.781 159.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.596 ' H ' ' HD2' ' A' ' 62' ' ' PRO . . . -108.27 -60.9 0.55 Allowed Glycine 0 CA--C 1.544 1.895 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 -158.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.596 ' HD2' ' H ' ' A' ' 61' ' ' GLY . 20.7 Cg_exo -47.44 -87.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.815 2.343 . . . . 0.0 113.733 -161.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 177.86 176.48 0.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.443 -171.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.28 61.39 1.08 Allowed Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.248 -1.141 . . . . 0.0 110.248 167.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -133.25 -73.76 0.49 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.337 -168.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.56 72.09 1.16 Allowed Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 170.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.474 ' NH2' ' HG ' ' A' ' 19' ' ' LEU . 11.2 mtm180 64.99 -167.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.414 175.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 160.29 -34.64 0.43 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -110.39 -30.65 3.27 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -173.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.48 176.54 8.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.323 -0.438 . . . . 0.0 110.244 -169.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 58.55 76.74 0.33 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.572 168.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.474 ' HB2' ' HE2' ' A' ' 76' ' ' LYS . 12.7 t -138.89 -62.16 0.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.413 -169.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -139.97 -79.07 0.3 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.416 -169.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.466 ' HB ' ' CE2' ' A' ' 75' ' ' PHE . 1.6 p -146.31 -54.16 0.26 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.357 178.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.466 ' CE2' ' HB ' ' A' ' 74' ' ' THR . 10.4 m-85 -141.45 113.25 7.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.324 -169.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 72' ' ' SER . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.544 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.405 170.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.487 1.092 0 N-CA-C 113.542 0.555 . . . . 0.0 113.542 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 6.4 pttp -126.12 156.21 40.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.36 -168.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -85.28 116.97 67.76 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.126 -163.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.611 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_endo -60.16 -21.85 67.74 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.584 2.189 . . . . 0.0 113.108 169.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -72.47 0.38 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.484 -173.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.6 p -91.84 -21.16 20.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.598 -169.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.02 52.29 0.13 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.597 -171.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -108.61 -169.33 1.48 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.884 158.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.497 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -106.76 151.72 24.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.531 160.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.7 t -112.68 124.91 69.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.711 -166.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.537 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 13.1 p90 -101.29 160.31 14.52 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.488 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HA ' ' HB3' ' A' ' 15' ' ' ARG . 7.0 p90 -59.61 -40.96 89.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.89 -158.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.479 ' H ' ' HD1' ' A' ' 11' ' ' TYR . . . -81.06 -0.09 38.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.161 -163.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 0.7 OUTLIER -113.37 9.74 18.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.686 166.203 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.433 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -80.66 141.15 35.22 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.36 -159.116 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.2 m -146.82 125.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.024 160.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -98.79 142.03 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.434 -168.556 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.5 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.6 138.65 0.22 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.566 -168.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' N ' HD22 ' A' ' 19' ' ' LEU . 3.2 mm? 59.92 32.49 21.21 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.726 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.41 -24.09 21.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 168.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.4 ' CE ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.35 -174.01 2.52 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 114.864 -0.668 . . . . 0.0 110.022 177.089 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.2 m-20 -106.4 177.05 4.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.309 -173.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.611 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 37.4 m95 -149.71 -172.29 4.11 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.267 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.5 m80 -101.65 159.44 15.31 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.558 170.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -74.3 -57.05 2.31 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.717 -175.522 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.448 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 4.2 Cg_exo -49.44 -22.47 6.16 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 C-N-CA 122.282 1.988 . . . . 0.0 113.411 172.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -87.0 -58.17 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.267 -167.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.92 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -62.81 83.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.348 -173.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.5 mtmt -156.67 139.55 15.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.266 -164.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -63.12 123.47 18.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.432 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 8.0 pt-20 -97.93 27.67 4.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.819 164.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.15 -50.76 2.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.351 170.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.99 -21.23 10.16 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.955 -175.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.45 43.02 16.69 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -99.81 122.42 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.343 168.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.0 m -60.84 137.19 58.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.32 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.821 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.6 mt -101.15 148.64 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.442 -162.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.504 HG22 ' N ' ' A' ' 39' ' ' SER . 97.5 m -102.73 168.81 9.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.369 -171.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.504 ' N ' HG22 ' A' ' 38' ' ' THR . 0.1 OUTLIER -62.87 78.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.57 179.517 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.43 58.49 0.96 Allowed Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.33 9.61 1.71 Allowed Glycine 0 C--N 1.334 0.458 0 CA-C-N 114.435 -0.882 . . . . 0.0 111.996 168.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.92 ' CE1' HD11 ' A' ' 28' ' ' LEU . 6.1 p80 -112.12 -171.31 1.82 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.983 0.42 . . . . 0.0 110.555 -170.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -141.64 -164.72 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.612 166.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.478 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.75 146.74 2.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.218 162.912 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.721 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 4.2 p-80 -86.96 -165.76 1.38 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.548 155.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.17 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.285 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.66 39.1 41.61 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 172.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.721 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -158.34 108.39 1.69 Allowed Pre-proline 0 CA--C 1.544 0.738 0 CA-C-O 121.315 0.579 . . . . 0.0 109.804 166.351 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 11.8 Cg_endo -71.46 154.14 60.59 Favored 'Trans proline' 0 N--CA 1.483 0.878 0 C-N-CA 122.963 2.442 . . . . 0.0 113.71 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 8.4 m-85 -147.14 -164.73 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.908 164.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.8 m -57.49 138.13 55.47 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.261 161.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -60.66 -30.66 70.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.172 163.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.433 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 34.4 m80 -164.37 164.84 13.57 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.355 168.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 12.2 Cg_endo -70.91 -12.96 14.6 Favored 'Cis proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.447 -1.897 . . . . 0.0 113.556 -15.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 68.9 m -59.72 -42.55 93.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.711 -157.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CD2' ' CB ' ' A' ' 43' ' ' ALA . 23.0 t80 -60.87 -45.07 95.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.507 176.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.433 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 25.3 t -76.2 -25.16 54.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.527 -172.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.55 -46.83 13.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.286 -174.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -81.83 -43.76 17.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.338 -169.045 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -93.47 96.11 9.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.412 -168.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.88 -165.74 19.76 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -60.96 -76.1 0.02 OUTLIER 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.528 2.152 . . . . 0.0 113.533 -170.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.74 146.66 45.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.473 -166.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.65 80.75 0.06 OUTLIER Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -67.34 -37.07 82.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.365 170.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 134.67 -42.16 1.38 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -169.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.7 113.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.491 171.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.02 133.49 49.18 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -170.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.55 64.66 0.35 Allowed Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 170.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.45 -57.74 1.28 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.313 170.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -125.63 -51.86 1.59 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.2 t 65.99 -78.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.349 170.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.511 ' O ' HG22 ' A' ' 74' ' ' THR . 5.3 p80 -98.8 15.23 26.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.725 -170.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.751 HG23 ' CD1' ' A' ' 75' ' ' PHE . 3.7 t 59.34 -163.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.002 167.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.751 ' CD1' HG23 ' A' ' 74' ' ' THR . 1.6 m-85 66.91 -69.43 0.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.357 -171.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.6 mttp . . . . . 0 C--O 1.241 0.63 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.357 170.04 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.486 1.065 0 N-CA-C 113.453 0.52 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.97 144.19 33.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.408 169.37 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.5 t -83.18 117.63 69.19 Favored Pre-proline 0 C--O 1.248 1.025 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.17 -162.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -60.46 -22.14 70.59 Favored 'Trans proline' 0 N--CA 1.489 1.227 0 C-N-CA 122.749 2.299 . . . . 0.0 113.222 169.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -73.25 0.31 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.396 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -94.44 -20.87 19.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.692 -165.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 t0 72.57 57.09 0.14 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.547 -172.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.95 -168.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.02 159.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.6 152.97 21.79 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.573 161.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -112.14 112.05 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.472 -163.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -75.75 159.51 30.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.382 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.34 -62.55 1.78 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.866 -159.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.48 -1.88 12.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.645 -173.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -101.86 14.08 32.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.478 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -98.74 146.31 26.02 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.374 -160.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.963 HG21 HD22 ' A' ' 28' ' ' LEU . 12.1 m -141.92 126.74 17.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.248 152.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 82.8 m -95.57 132.38 40.76 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.401 -175.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.461 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -162.65 122.58 2.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.224 -159.876 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.684 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.05 23.77 12.98 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.67 -176.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.73 17.06 66.63 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.696 -0.961 . . . . 0.0 110.696 164.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -151.21 150.38 30.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 162.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.2 178.29 8.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.252 -160.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.9 m95 -152.2 -177.32 6.11 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.237 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.9 m80 -101.09 143.63 30.98 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.053 -1.431 . . . . 0.0 110.526 170.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.4 ttp180 -61.18 -46.48 95.82 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.78 -173.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -58.88 -27.64 84.97 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.647 2.231 . . . . 0.0 113.585 174.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -81.04 -46.96 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.051 HD21 ' CE1' ' A' ' 42' ' ' HIS . 8.0 tp -60.78 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.442 -173.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 13.1 mtmt -135.9 127.48 28.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.409 -164.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -61.35 125.88 25.37 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.353 167.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.0 tp10 -95.65 30.4 2.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.123 168.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.98 -43.03 1.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.173 -177.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.3 p -120.09 -9.32 9.62 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.815 -1.084 . . . . 0.0 111.212 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.82 37.9 95.36 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -95.0 121.47 36.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.28 172.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.2 m -61.31 135.97 57.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.17 166.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 42' ' ' HIS . 27.3 mt -102.11 123.45 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.378 -165.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -84.38 -175.65 5.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.498 169.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.4 p -61.06 -9.85 5.15 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.506 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.81 ' H ' HG23 ' A' ' 38' ' ' THR . . . -63.51 -170.04 1.5 Allowed Glycine 0 CA--C 1.532 1.094 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.736 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.19 76.52 2.13 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -158.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 1.051 ' CE1' HD21 ' A' ' 28' ' ' LEU . 33.0 p-80 -98.61 -167.02 1.43 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.264 -0.968 . . . . 0.0 110.572 169.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.58 -166.67 1.54 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.799 -169.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.53 154.26 3.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.167 164.956 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.54 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 15.0 p80 -92.21 -167.66 1.81 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.533 156.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.98 91.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.173 -176.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.67 53.87 9.28 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 178.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 6.1 ttmm -179.78 106.96 0.19 Allowed Pre-proline 0 CA--C 1.541 0.613 0 CA-C-O 121.764 0.792 . . . . 0.0 110.021 165.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.8 Cg_endo -71.21 148.82 56.6 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.744 2.296 . . . . 0.0 113.665 173.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.7 m-85 -144.1 -171.91 3.66 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.767 162.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 79.5 m -58.2 137.7 56.83 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.156 165.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -67.88 -34.37 76.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.58 -1.191 . . . . 0.0 109.993 163.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -150.36 167.68 12.52 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.406 165.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.29 -20.39 6.64 Favored 'Cis proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.818 -2.159 . . . . 0.0 112.628 -21.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.6 m -57.31 -48.13 79.73 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.235 -153.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.479 ' CD1' ' HB2' ' A' ' 60' ' ' PHE . 55.0 t80 -61.07 -55.46 32.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.409 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.9 t -60.82 -17.74 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.564 -174.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.35 -53.49 4.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.193 -168.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -95.69 -38.34 10.4 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.332 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.479 ' HB2' ' CD1' ' A' ' 56' ' ' TYR . 31.4 m-85 -91.0 -170.24 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.177 165.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.404 ' N ' ' CD ' ' A' ' 62' ' ' PRO . . . 169.41 -56.04 0.2 Allowed Glycine 0 CA--C 1.542 1.763 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.404 ' CD ' ' N ' ' A' ' 61' ' ' GLY . 7.1 Cg_exo -50.95 112.38 0.76 Allowed 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.429 2.086 . . . . 0.0 113.587 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HB3' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -158.81 122.61 3.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.436 -169.422 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.55 -33.89 87.87 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.477 ' CE2' ' HB3' ' A' ' 63' ' ' LYS . 6.2 m-85 69.81 -80.45 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.331 -0.434 . . . . 0.0 110.386 169.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -114.5 176.48 16.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -169.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.54 83.56 2.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.392 -170.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 155.01 134.04 1.82 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -170.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -160.24 163.71 34.02 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -178.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.32 -162.75 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.226 169.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.42 111.32 21.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.038 168.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.5 p -177.54 165.87 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.308 169.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 t60 71.74 -67.67 0.25 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.375 170.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.9 p -61.01 -86.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.406 -169.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -108.3 122.29 46.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.292 -169.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 170.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.086 0 N-CA-C 113.478 0.53 . . . . 0.0 113.478 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -145.13 136.89 25.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.277 -170.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 32.0 t -85.11 119.92 72.97 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.043 -162.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -63.25 -19.6 68.81 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 C-N-CA 122.971 2.447 . . . . 0.0 113.375 171.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.498 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 0.2 OUTLIER -85.05 -64.47 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.473 -171.053 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.5 p -96.48 -23.76 16.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.684 -170.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 72.21 64.55 0.13 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.512 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.5 OUTLIER -127.38 -170.81 2.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.105 162.019 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -99.66 150.48 22.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.306 163.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.928 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.9 t -112.58 113.64 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.505 -163.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -68.43 150.79 47.7 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.461 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.35 -62.82 1.59 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.834 -159.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -1.88 11.55 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.603 -174.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -101.85 13.2 35.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.302 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -96.44 155.8 16.61 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.249 -161.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.95 HG21 HD22 ' A' ' 28' ' ' LEU . 15.5 m -144.49 145.16 21.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.423 155.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -114.69 137.59 51.73 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.652 -168.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.531 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 8.7 t -177.69 128.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.334 -169.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.658 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.06 28.63 18.2 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.588 -172.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.38 17.5 72.51 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 167.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mmtt -137.22 153.19 50.45 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 163.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.41 176.77 7.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.399 -167.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.572 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 33.9 m95 -148.38 175.53 11.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 114.231 -1.35 . . . . 0.0 109.411 -177.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.928 ' CD2' HG22 ' A' ' 10' ' ' VAL . 40.5 m80 -96.81 138.97 33.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.392 167.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.7 tpp180 -60.94 -47.06 96.63 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.861 -165.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -62.23 -35.24 75.42 Favored 'Trans proline' 0 N--CA 1.484 0.914 0 C-N-CA 122.53 2.153 . . . . 0.0 113.666 174.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.498 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.3 m -61.21 -41.32 96.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.173 -171.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.95 HD22 HG21 ' A' ' 16' ' ' VAL . 10.2 tp -67.79 103.35 1.41 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -164.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -146.92 157.08 43.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.31 -178.519 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.1 t -72.18 127.42 32.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.367 171.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -95.83 35.87 1.35 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 114.078 -1.419 . . . . 0.0 110.168 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.502 ' HB2' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -138.08 -46.47 0.52 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.283 -176.258 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -115.87 -18.78 10.67 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.124 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.29 38.85 28.2 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -108.0 136.9 46.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.007 -0.597 . . . . 0.0 110.565 173.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -61.68 150.3 36.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.325 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.616 HD13 ' CB ' ' A' ' 42' ' ' HIS . 42.6 mt -113.28 154.9 26.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.398 -167.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -88.21 -170.57 3.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.396 -175.214 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.629 ' H ' HG22 ' A' ' 38' ' ' THR . 16.3 t -61.65 -42.37 98.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.416 -176.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.58 59.5 0.42 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -128.21 13.45 6.31 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 111.63 -0.588 . . . . 0.0 111.63 173.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.781 ' NE2' HD11 ' A' ' 28' ' ' LEU . 28.0 p-80 -114.04 -167.65 1.24 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.031 -0.584 . . . . 0.0 110.481 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -174.11 159.1 3.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.044 165.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.8 pp20? -110.3 134.96 51.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.074 -163.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 85.4 t60 -128.11 99.09 5.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.229 -1.35 . . . . 0.0 109.878 175.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 58.47 41.58 22.48 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.747 -173.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.435 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.18 -22.61 38.81 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 168.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -92.36 102.27 6.26 Favored Pre-proline 0 C--O 1.243 0.742 0 CA-C-O 121.253 0.549 . . . . 0.0 109.812 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 8.1 Cg_endo -58.61 167.91 4.65 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.482 2.121 . . . . 0.0 113.468 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 32.1 m-85 -164.46 170.17 16.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.892 -167.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -57.3 133.98 55.58 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 113.85 -1.523 . . . . 0.0 110.269 160.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -61.02 -27.99 68.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.07 164.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.47 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 32.6 m80 -163.8 163.79 15.55 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.354 165.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -72.36 -13.53 17.32 Favored 'Cis proline' 0 N--CA 1.482 0.824 0 C-N-CA 122.645 -1.815 . . . . 0.0 113.578 -13.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.656 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 76.2 m -59.83 -46.34 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -157.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.13 -47.91 80.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.339 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.47 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.26 -14.14 61.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.298 178.396 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . -69.98 -57.0 5.52 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.183 176.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 60' ' ' PHE . 16.2 mmt -91.53 -16.19 27.57 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 113.749 -1.568 . . . . 0.0 110.346 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 3.2 m-85 -147.64 -168.61 3.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.845 -165.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.36 145.94 10.47 Favored Glycine 0 CA--C 1.543 1.811 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -176.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -61.97 -158.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.503 2.135 . . . . 0.0 113.617 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.99 147.71 23.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.418 169.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.25 107.81 1.81 Allowed Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.464 -1.055 . . . . 0.0 110.464 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 66.96 -80.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.398 . . . . 0.0 110.374 169.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.53 118.72 11.19 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 -169.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.08 140.29 49.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.421 170.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.59 -102.88 0.67 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 170.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.25 63.98 1.68 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 170.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -168.82 123.91 0.9 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.371 -0.414 . . . . 0.0 110.278 169.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -135.14 -75.98 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.958 -168.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.57 139.93 21.36 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.446 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.76 -50.79 5.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.298 169.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.4 HG22 ' H ' ' A' ' 75' ' ' PHE . 0.2 OUTLIER 69.32 171.01 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.37 -170.57 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.4 ' H ' HG22 ' A' ' 74' ' ' THR . 1.6 m-85 71.77 -75.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.438 -177.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.345 170.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.488 ' HD3' ' NZ ' ' A' ' 21' ' ' LYS . 10.2 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.54 0.554 . . . . 0.0 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.429 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -118.86 159.2 24.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.423 -168.828 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.8 t -81.94 118.72 73.12 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.391 -162.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -59.24 -19.38 49.78 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.766 2.311 . . . . 0.0 113.252 167.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.562 ' HE3' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -83.36 -77.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.431 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.24 -18.8 22.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.035 -162.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 t70 71.88 51.92 0.22 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.485 -175.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -168.6 1.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.008 161.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' HG2' ' CD ' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.71 153.07 21.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.657 162.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.7 t -112.39 112.95 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.581 -163.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -70.66 154.98 41.33 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.29 177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -60.68 -62.29 1.97 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.796 -160.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.48 10.82 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.614 -173.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -102.46 14.52 31.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.475 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ptt-85 -96.42 155.13 16.89 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.214 -161.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.811 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -147.31 151.73 13.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.812 157.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.58 137.84 47.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.664 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.8 t -176.02 137.58 0.32 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.143 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.578 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 59.97 18.97 8.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.574 -171.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.45 28.93 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.488 ' NZ ' ' HD3' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -107.0 157.64 17.64 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.943 -0.629 . . . . 0.0 110.269 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.26 176.83 7.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.382 -166.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.8 m95 -149.54 -176.08 5.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.105 -177.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.0 m80 -100.36 138.61 37.19 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.91 -1.495 . . . . 0.0 110.543 169.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.3 ttp-105 -61.17 -47.6 94.23 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.803 -175.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.2 Cg_exo -52.44 -33.5 57.3 Favored 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 122.584 2.189 . . . . 0.0 113.6 170.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -77.63 -55.53 5.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.252 -170.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.811 HD22 HG21 ' A' ' 16' ' ' VAL . 3.0 tp -61.48 78.26 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.381 -175.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 ptpt -137.31 155.44 49.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.416 170.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -59.51 125.88 25.38 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.651 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -93.53 22.67 5.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.226 170.738 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.485 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.08 -60.11 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.33 166.886 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.4 p -106.32 -21.22 13.16 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.902 -167.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.84 40.98 20.12 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 124.06 33.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.445 -0.377 . . . . 0.0 110.26 165.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 36.6 m -61.56 135.84 57.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.133 166.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 95.9 mt -102.97 110.16 21.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.388 -161.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 39' ' ' SER . 4.9 t -98.86 -167.06 1.43 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.44 171.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.657 ' HB3' HG23 ' A' ' 38' ' ' THR . 24.9 p 58.79 -162.73 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.564 158.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -122.36 47.74 1.0 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 157.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -103.14 15.31 54.92 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.449 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.1 p-80 -104.6 -170.48 1.77 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.473 0.654 . . . . 0.0 111.055 176.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.48 -166.05 2.37 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.161 175.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -170.87 164.91 7.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.885 164.693 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.536 ' NE2' ' HG2' ' A' ' 48' ' ' LYS . 31.8 p80 -111.05 106.14 15.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.715 163.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.15 14.85 2.95 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.006 165.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.539 ' HA2' ' HB2' ' A' ' 4' ' ' PRO . . . 126.99 16.28 2.43 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.562 ' HD3' ' HE3' ' A' ' 5' ' ' LYS . 9.4 tppt? -129.66 86.49 55.38 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -173.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.566 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.4 Cg_endo -71.29 155.56 60.33 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.665 2.243 . . . . 0.0 113.721 -168.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.7 m-85 -152.99 -164.12 1.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.813 167.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.1 m -58.18 137.34 57.1 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.103 159.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -61.32 -31.58 71.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.964 162.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.589 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 47.7 m80 -161.53 164.56 18.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.34 170.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.415 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.9 Cg_endo -70.31 -11.7 13.06 Favored 'Cis proline' 0 N--CA 1.483 0.906 0 C-N-CA 122.465 -1.89 . . . . 0.0 113.365 -15.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.5 m -61.99 -45.38 93.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.685 -157.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -61.03 -47.49 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.425 176.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.589 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.05 -15.07 62.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.543 -176.009 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.88 -47.83 8.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.209 -173.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 15.9 mtp -90.2 -40.41 12.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.36 -169.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.45 ' CZ ' ' CB ' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -82.19 95.57 7.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.401 -166.49 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -125.07 67.88 0.52 Allowed Glycine 0 CA--C 1.544 1.906 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 168.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.03 114.01 1.43 Allowed 'Trans proline' 0 N--CA 1.486 1.075 0 C-N-CA 122.579 2.186 . . . . 0.0 113.448 -168.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.443 ' N ' ' HD2' ' A' ' 63' ' ' LYS . 0.1 OUTLIER 60.99 86.97 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.387 169.622 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.24 122.13 4.69 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 -169.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -166.4 -79.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.412 . . . . 0.0 110.434 170.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -98.87 -91.1 2.0 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -170.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.7 mtp180 -107.03 -80.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.37 -170.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.66 131.46 6.0 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -170.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -67.68 -172.23 6.09 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 170.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.714 ' HB3' HG21 ' A' ' 74' ' ' THR . . . 61.71 -169.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.39 -0.405 . . . . 0.0 110.279 169.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.43 163.12 17.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.015 -168.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 72.3 m 65.9 -84.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.412 169.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -166.92 108.13 0.65 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.348 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.714 HG21 ' HB3' ' A' ' 70' ' ' ALA . 3.9 t -159.17 -59.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.379 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.594 ' H ' HG23 ' A' ' 74' ' ' THR . 4.9 t80 67.31 -79.59 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.408 170.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 1.5 tmmt? . . . . . 0 C--O 1.24 0.597 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.34 175.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 113.538 0.553 . . . . 0.0 113.538 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 3.1 pttt -119.76 154.88 33.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.355 -167.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.2 t -78.44 117.64 67.52 Favored Pre-proline 0 C--O 1.248 0.974 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.637 -164.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -62.7 -6.88 9.8 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 123.031 2.487 . . . . 0.0 113.397 168.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.556 ' CE ' ' HD2' ' A' ' 49' ' ' PRO . 10.8 tptp -97.69 -75.87 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.346 -178.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -89.89 -12.35 39.21 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.536 -168.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 p30 59.98 53.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.624 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 -168.55 1.44 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.78 157.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -110.17 155.4 22.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.518 0.675 . . . . 0.0 109.626 159.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 26.4 t -112.94 114.08 45.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.476 -157.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.04 156.0 39.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.376 177.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 15' ' ' ARG . 9.9 t80 -60.57 -59.4 5.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 -158.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.44 -0.77 13.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.571 -171.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -102.96 11.94 36.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.585 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.472 ' HD3' ' CD1' ' A' ' 12' ' ' PHE . 2.2 ptm180 -93.55 151.81 19.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.361 -160.35 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.982 HG21 HD22 ' A' ' 28' ' ' LEU . 15.9 m -145.75 145.58 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.494 155.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.22 135.45 54.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.635 -167.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.8 t -178.49 134.13 0.14 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.182 -168.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.55 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.2 mm? 59.96 18.62 7.71 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.656 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.23 -24.66 30.39 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 167.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mmpm? -110.1 159.18 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 114.815 -0.693 . . . . 0.0 110.107 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.93 176.5 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.289 -166.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.3 m95 -148.29 -179.97 7.33 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.184 -1.371 . . . . 0.0 109.106 -177.169 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -99.78 141.42 32.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.542 166.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.611 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.55 -49.44 86.96 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.177 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.611 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -59.13 -30.4 93.07 Favored 'Trans proline' 0 N--CA 1.484 0.929 0 C-N-CA 122.456 2.104 . . . . 0.0 113.74 176.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.9 -45.35 67.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.277 -175.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 HG21 ' A' ' 16' ' ' VAL . 9.8 tp -64.91 84.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.325 -167.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -136.82 141.0 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.49 -169.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -67.78 124.12 22.44 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.445 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.85 42.72 1.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.237 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.537 ' HE3' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -140.52 -37.46 0.46 Allowed 'General case' 0 C--O 1.231 0.097 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.701 -178.287 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -117.52 -31.06 5.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.041 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.13 51.51 4.41 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -173.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.2 126.93 52.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.901 0.381 . . . . 0.0 110.116 164.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.4 m -61.25 133.57 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.228 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.538 HD13 ' HB2' ' A' ' 42' ' ' HIS . 92.1 mt -94.08 143.93 25.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.421 -163.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.874 HG22 ' H ' ' A' ' 40' ' ' GLY . 95.0 m -62.56 155.84 24.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.832 161.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.476 ' OG ' HG12 ' A' ' 16' ' ' VAL . 71.1 m -60.55 -21.07 62.14 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.083 178.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.874 ' H ' HG22 ' A' ' 38' ' ' THR . . . -121.76 179.69 16.19 Favored Glycine 0 CA--C 1.527 0.836 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.537 162.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.25 13.93 82.77 Favored Glycine 0 C--N 1.342 0.878 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.174 172.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.538 ' HB2' HD13 ' A' ' 37' ' ' LEU . 46.4 p-80 -110.64 -167.33 1.17 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 113.967 -1.116 . . . . 0.0 110.468 169.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.51 160.36 7.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.151 159.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.55 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -114.88 122.46 46.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.213 -164.321 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.552 ' HB2' ' HG3' ' A' ' 48' ' ' LYS . 1.7 m80 -75.99 -168.25 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.877 160.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.39 85.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.027 -170.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.29 54.41 37.48 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.552 ' HG3' ' HB2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -168.04 105.52 0.56 Allowed Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.706 0.765 . . . . 0.0 109.935 170.35 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.556 ' HD2' ' CE ' ' A' ' 5' ' ' LYS . 14.0 Cg_endo -65.46 146.16 84.49 Favored 'Trans proline' 0 N--CA 1.484 0.92 0 C-N-CA 122.824 2.349 . . . . 0.0 113.624 169.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 22.4 m-85 -143.65 -166.05 2.24 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.843 168.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 94.5 m -57.49 129.71 43.03 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.748 -1.569 . . . . 0.0 110.278 165.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 23.0 t30 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.813 159.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 64.2 m80 -155.34 163.24 25.25 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.268 164.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.481 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -72.99 -19.13 15.7 Favored 'Cis proline' 0 C--N 1.352 0.746 0 C-N-CA 122.708 -1.788 . . . . 0.0 113.712 -11.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.1 m -59.1 -45.63 90.39 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.812 -155.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -61.17 -48.63 80.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.427 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.67 23.76 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.738 -172.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -113.13 -52.59 2.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.234 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.537 ' HG3' ' HE3' ' A' ' 32' ' ' LYS . 12.0 mmt -83.1 -44.69 14.85 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.827 174.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -98.27 -168.37 1.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.091 161.349 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.516 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 130.85 66.01 0.1 OUTLIER Glycine 0 CA--C 1.544 1.846 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 172.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.516 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 11.0 Cg_endo -58.86 174.2 0.94 Allowed 'Trans proline' 0 N--CA 1.485 1.02 0 C-N-CA 122.593 2.195 . . . . 0.0 113.498 169.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.17 -30.41 6.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.4 168.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.81 118.91 5.84 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 169.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -61.12 133.29 55.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.361 -0.419 . . . . 0.0 110.264 -169.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 63.41 -178.51 6.6 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 -170.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.33 107.76 10.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.374 170.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.97 131.22 3.54 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.38 -1.088 . . . . 0.0 110.38 -170.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -131.33 107.01 0.71 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -170.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -92.69 -71.49 0.65 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.259 169.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 58.53 111.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 168.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.7 t -171.0 34.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.459 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -175.22 108.44 0.1 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.348 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -118.06 -60.75 1.76 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.418 169.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.85 96.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.384 169.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.556 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.356 170.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.403 ' HD2' ' OD1' ' A' ' 22' ' ' ASP . 23.2 Cg_exo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 113.589 0.573 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.47 159.21 26.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.545 -166.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.0 t -88.04 118.78 70.03 Favored Pre-proline 0 C--O 1.25 1.131 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.221 -162.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -58.81 -23.76 68.53 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.788 2.325 . . . . 0.0 113.14 169.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.79 -73.99 0.28 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.421 -176.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -94.42 -22.05 18.54 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.632 -164.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 71.93 61.6 0.14 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.556 -169.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.71 -167.76 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.058 162.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -103.36 147.66 26.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.299 163.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 49.1 t -109.46 111.97 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.68 -166.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.01 160.77 30.12 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.392 177.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.57 -63.02 1.44 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.75 -160.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.26 -11.0 60.59 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.71 -174.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.22 40.58 1.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.284 172.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.2 149.72 28.97 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.47 -176.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.496 HG21 HD22 ' A' ' 28' ' ' LEU . 18.3 m -143.47 145.71 22.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.475 155.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -113.81 139.5 49.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.546 -166.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.415 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 36.8 t -178.1 131.66 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.314 -171.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.621 HD21 ' OE1' ' A' ' 44' ' ' GLU . 3.1 mm? 59.99 18.82 7.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.551 -171.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.77 -24.47 26.04 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -105.33 157.72 17.13 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.808 -0.696 . . . . 0.0 110.026 179.262 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.403 ' OD1' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -92.16 177.47 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.299 -163.565 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.5 m95 -151.87 -175.13 5.1 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.067 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -101.16 144.83 29.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.474 169.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 34.6 tpt85 -61.62 -48.84 89.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.714 -170.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.4 Cg_endo -59.98 -31.71 93.96 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.597 2.198 . . . . 0.0 113.634 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -71.61 -44.99 63.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.278 -167.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.651 HD21 ' CE1' ' A' ' 42' ' ' HIS . 6.9 tp -66.48 77.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.441 -167.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -133.73 146.76 51.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.283 -173.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.9 t -60.19 128.81 38.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.403 169.168 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.501 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.2 mm-40 -99.85 26.13 6.61 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.129 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.561 ' HE2' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -114.82 -60.33 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.351 164.305 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.6 p -99.99 -20.41 16.1 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.766 -170.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.79 42.91 24.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.4 mmtt -119.04 130.01 55.41 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.988 -0.606 . . . . 0.0 110.373 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 m -61.43 149.85 37.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.449 -173.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.554 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 64.9 mt -110.63 125.59 53.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.378 -166.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -83.54 -166.84 1.49 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.705 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t -95.31 35.59 1.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 -165.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.49 58.44 0.01 OUTLIER Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 160.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -139.24 11.21 3.29 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 114.672 -0.764 . . . . 0.0 111.838 163.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.651 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.3 p-80 -113.46 -169.54 1.52 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.201 -0.5 . . . . 0.0 110.982 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 42' ' ' HIS . . . -146.75 -166.86 2.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.816 -1.083 . . . . 0.0 110.05 168.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.621 ' OE1' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.38 134.83 33.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.168 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 55.7 t-80 -114.46 162.52 16.57 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 161.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.453 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 50.5 mm-40 -60.06 90.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.332 -160.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.47 25.71 6.85 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 174.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.542 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 176.45 140.43 0.22 Allowed Pre-proline 0 C--O 1.242 0.705 0 CA-C-O 121.264 0.554 . . . . 0.0 109.778 161.497 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.651 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.6 Cg_endo -66.96 161.0 44.43 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 123.038 2.492 . . . . 0.0 113.609 164.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.542 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 65.0 m-85 -150.4 -173.88 4.59 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.881 168.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.8 m -58.12 132.52 53.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 113.789 -1.55 . . . . 0.0 110.159 161.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.442 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 14.0 t-20 -61.12 -33.2 73.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.882 164.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.449 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 53.6 m80 -158.35 162.89 25.97 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.318 163.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.28 -18.18 16.81 Favored 'Cis proline' 0 C--N 1.353 0.81 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.646 -11.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 82.7 m -59.24 -43.14 92.41 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.907 -154.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.98 -61.31 2.67 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.376 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -35.67 81.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.456 -174.001 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.16 -47.95 12.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.185 -167.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.561 ' HG2' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -94.36 -37.7 11.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.518 -162.256 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 0.2 OUTLIER -61.05 90.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.333 -164.323 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 175.19 166.72 33.36 Favored Glycine 0 CA--C 1.546 1.98 0 N-CA-C 109.494 -1.443 . . . . 0.0 109.494 -168.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -68.34 56.87 0.9 Allowed 'Trans proline' 0 N--CA 1.485 0.98 0 C-N-CA 122.732 2.288 . . . . 0.0 113.777 -166.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 1.5 tptt 60.28 27.32 16.84 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.619 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.61 92.98 0.07 OUTLIER Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -170.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 10.8 t80 175.59 -78.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.243 -0.479 . . . . 0.0 110.299 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.03 174.89 2.0 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 166.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -64.82 110.26 2.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.369 -0.416 . . . . 0.0 110.386 168.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -13.28 34.22 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.46 -131.49 10.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -178.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.27 106.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.31 169.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -77.52 -56.44 4.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.998 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p 61.43 -164.11 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.402 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 149.16 52.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.293 169.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 49.1 p -60.86 177.09 0.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.516 -169.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -72.95 -174.32 1.46 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.351 -169.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HA ' ' CE ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.647 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.372 170.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo . . . . . 0 N--CA 1.483 0.904 0 N-CA-C 113.595 0.575 . . . . 0.0 113.595 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.08 147.85 51.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.477 171.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -85.13 121.25 74.04 Favored Pre-proline 0 C--O 1.25 1.126 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.044 -166.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.595 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.22 -33.27 90.56 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 122.888 2.392 . . . . 0.0 113.097 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -63.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.42 -168.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -97.78 -24.17 15.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.749 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 72.6 57.33 0.13 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.519 -171.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.32 -168.75 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.972 160.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -104.35 153.69 20.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.637 161.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.4 t -112.94 112.03 38.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.546 -163.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.487 ' CZ ' ' CE1' ' A' ' 12' ' ' PHE . 14.2 t80 -73.14 155.17 39.93 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.181 177.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.2 -59.44 5.41 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -158.827 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 -0.43 12.94 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.506 -172.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -105.81 17.81 23.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.353 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -96.3 152.09 18.91 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.249 -163.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.463 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.92 145.35 21.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.59 156.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -115.38 137.11 52.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.517 -165.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 t -178.46 128.04 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.247 -170.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.84 36.02 21.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.627 -171.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.12 17.9 53.39 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 168.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.69 156.49 47.36 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 164.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.18 176.69 6.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.319 -165.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.595 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.6 m95 -149.63 -176.84 5.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.12 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -99.93 146.5 26.6 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 113.954 -1.475 . . . . 0.0 110.585 168.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -61.02 -48.35 92.73 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.774 -168.234 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.3 Cg_endo -63.63 -35.31 59.4 Favored 'Trans proline' 0 N--CA 1.483 0.868 0 C-N-CA 122.555 2.17 . . . . 0.0 113.638 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.95 -50.73 65.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.209 -164.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.817 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -60.31 89.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.353 -163.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.494 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 57.3 mttt -148.69 149.81 32.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.393 -165.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.9 t -69.04 126.43 29.77 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.451 175.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.9 33.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.066 169.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' NZ ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -130.25 -49.53 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.198 179.104 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.447 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 29.3 p -113.5 -18.49 11.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.214 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.97 39.7 53.65 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -99.29 131.42 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.302 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 28.3 m -60.87 139.57 57.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.465 171.214 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 51.7 mt -103.07 121.75 43.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.359 -169.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -83.25 -169.08 2.36 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.48 -173.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.1 p -74.47 77.39 1.93 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.376 -167.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.42 56.1 1.72 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 168.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.75 11.87 4.25 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 166.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.817 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.2 p80 -107.36 -170.32 1.68 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.106 -0.547 . . . . 0.0 110.451 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.87 158.7 10.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.833 163.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 17.8 pt-20 -112.77 128.33 56.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.211 -160.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.479 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.44 151.97 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.419 157.015 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -62.67 75.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.003 -172.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.449 ' HA3' ' NZ ' ' A' ' 48' ' ' LYS . . . 162.45 -53.52 0.31 Allowed Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.715 -167.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -155.16 140.48 12.37 Favored Pre-proline 0 C--O 1.242 0.68 0 CA-C-O 121.39 0.614 . . . . 0.0 110.048 -163.81 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.9 Cg_endo -68.46 149.35 74.64 Favored 'Trans proline' 0 N--CA 1.486 1.032 0 C-N-CA 123.08 2.52 . . . . 0.0 113.708 166.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 8.4 m-85 -138.8 -173.65 3.62 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.79 167.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 86.0 m -57.52 134.59 56.24 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 113.458 -1.701 . . . . 0.0 110.348 164.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.88 -37.15 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.021 162.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.517 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 64.3 m80 -152.68 169.82 9.04 Favored Pre-proline 0 CA--C 1.546 0.81 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 163.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.517 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 22.2 Cg_endo -66.12 -21.47 7.17 Favored 'Cis proline' 0 N--CA 1.491 1.347 0 C-N-CA 122.113 -2.036 . . . . 0.0 112.655 -19.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 73.4 m -57.11 -42.92 81.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.251 -153.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -61.03 -56.32 22.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.458 175.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.98 24.28 6.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.507 -166.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -122.11 -48.59 2.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.256 174.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.2 mmt -101.23 -18.36 16.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.506 -176.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -134.21 14.74 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.366 -165.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.24 160.58 42.4 Favored Glycine 0 CA--C 1.544 1.876 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -171.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -56.12 -18.92 24.95 Favored 'Trans proline' 0 N--CA 1.485 0.971 0 C-N-CA 122.702 2.268 . . . . 0.0 113.559 170.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt 58.84 -169.76 0.13 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.443 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.03 131.51 13.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 -169.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 67.8 162.68 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.349 168.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 172.89 57.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 170.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.8 158.3 30.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.395 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -166.89 -130.69 1.18 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -144.92 -86.05 0.07 OUTLIER Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -170.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -175.43 149.59 1.03 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.411 -0.395 . . . . 0.0 110.324 -169.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.46 139.29 58.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.959 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.99 124.62 21.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.37 -169.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -119.34 -66.6 1.05 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 93.1 m -94.71 139.7 30.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.395 170.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -95.03 145.09 25.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.284 -170.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.0 mmmm . . . . . 0 C--O 1.239 0.536 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.407 -170.063 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.428 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 5.3 Cg_exo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.59 158.77 29.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.355 -167.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.3 t -80.59 119.36 76.04 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.349 -161.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -61.1 -18.83 60.42 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.877 2.385 . . . . 0.0 113.198 167.852 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.452 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.9 OUTLIER -83.02 -77.65 0.24 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.424 -179.428 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -90.96 -20.12 22.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.918 -164.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.22 52.54 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.463 -173.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.81 -168.13 1.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.979 159.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 149.59 27.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.355 167.035 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.5 t -111.31 113.53 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.467 -161.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.4 ' HB3' ' CG ' ' A' ' 14' ' ' GLU . 1.4 t80 -77.7 158.75 29.53 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.457 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.11 -62.71 1.67 Allowed 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 -158.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.21 -13.29 61.87 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.813 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HB3' ' A' ' 11' ' ' TYR . 1.9 pm0 -102.78 52.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.783 167.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -115.81 148.63 39.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.527 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.856 HG21 HD22 ' A' ' 28' ' ' LEU . 10.2 m -137.35 141.25 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.478 151.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.8 m -105.34 131.03 53.29 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.523 -176.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -168.71 122.72 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.197 -164.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.654 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.17 32.97 21.08 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.77 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.93 18.5 78.71 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 163.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -154.72 160.05 41.1 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 164.372 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.428 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -85.75 176.89 7.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.285 -165.31 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.6 m95 -152.91 -176.45 5.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.03 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 39.2 m80 -101.76 142.26 33.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.476 168.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -61.16 -50.59 83.47 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.732 -169.469 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 7.3 Cg_exo -57.38 -34.93 98.75 Favored 'Trans proline' 0 N--CA 1.483 0.9 0 C-N-CA 122.618 2.212 . . . . 0.0 113.545 174.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.8 m -65.74 -46.47 78.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.352 -169.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.028 HD21 ' CE1' ' A' ' 42' ' ' HIS . 11.3 tp -60.84 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.332 -165.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -139.73 146.63 39.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.327 -164.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.0 t -70.66 119.77 15.3 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 167.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -97.71 29.03 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.988 165.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tptp -110.48 -52.35 2.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.116 170.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.8 -24.36 10.91 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.752 -177.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.72 44.62 7.17 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 2.4 mmtm -111.15 119.82 40.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.306 -0.447 . . . . 0.0 110.401 168.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.5 m -61.08 161.72 8.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.319 168.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.879 HD13 ' HB2' ' A' ' 42' ' ' HIS . 5.0 mt -131.78 147.32 52.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.351 -165.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -83.47 -166.2 1.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.586 174.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.0 t -95.76 32.11 1.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.346 -169.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 167.22 57.36 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 164.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.25 12.0 2.29 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 114.763 -0.718 . . . . 0.0 111.825 170.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 1.028 ' CE1' HD21 ' A' ' 28' ' ' LEU . 24.9 p-80 -112.75 -174.62 2.49 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.47 -175.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.62 -177.27 6.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 164.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.547 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 mp0 -140.72 114.77 9.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.059 -164.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CD2' ' CE2' ' A' ' 60' ' ' PHE . 1.3 m80 -74.0 -167.84 0.54 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.821 157.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.39 86.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.199 -173.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.25 47.34 91.58 Favored Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.734 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.9 103.26 1.93 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 121.851 0.834 . . . . 0.0 109.848 -175.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 12.3 Cg_endo -66.87 145.2 73.76 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 122.594 2.196 . . . . 0.0 113.79 177.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -143.63 -168.32 2.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.848 171.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 69.2 m -57.51 134.56 56.2 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.197 161.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -61.28 -33.48 73.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.89 160.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 63.1 m80 -157.13 163.81 23.78 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.193 164.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.3 Cg_endo -73.2 -17.42 17.31 Favored 'Cis proline' 0 C--N 1.354 0.828 0 C-N-CA 122.627 -1.822 . . . . 0.0 113.558 -14.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.3 m -59.5 -38.06 79.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.723 -155.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.489 ' CE2' ' CD2' ' A' ' 60' ' ' PHE . 42.0 t80 -62.35 -54.8 35.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.385 168.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.741 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 2.0 t -61.83 -12.69 18.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.464 -173.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.09 -40.67 12.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.287 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -38.92 20.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.407 -179.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CE2' ' CD2' ' A' ' 45' ' ' HIS . 37.3 m-85 -98.94 92.31 5.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.435 -168.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.48 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 120.19 69.74 0.3 Allowed Glycine 0 CA--C 1.542 1.728 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 169.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.48 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 1.7 Cg_endo -57.7 -23.13 56.22 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.502 2.135 . . . . 0.0 113.552 170.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -73.52 0.39 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.46 172.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 61.09 31.22 75.91 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 170.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -109.88 171.58 7.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.042 -0.579 . . . . 0.0 110.309 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.64 90.82 2.12 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 -170.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.499 ' NH1' ' HB2' ' A' ' 71' ' ' GLU . 10.0 tpt180 64.87 142.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.438 -170.334 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.02 90.22 1.85 Allowed Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -170.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.15 44.11 0.22 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 177.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.26 99.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.351 -0.425 . . . . 0.0 110.274 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' HB2' ' NH1' ' A' ' 67' ' ' ARG . 2.6 tt0 -94.23 117.92 30.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.04 169.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.3 p -64.4 -164.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.406 169.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.7 m170 68.67 25.79 6.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.295 -170.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.517 HG23 ' HG2' ' A' ' 76' ' ' LYS . 5.5 t -105.57 160.62 15.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.389 169.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -95.9 26.15 4.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.26 -169.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.517 ' HG2' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.24 0.595 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.349 170.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.099 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -131.11 156.41 45.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.432 170.872 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.1 t -83.09 118.93 73.18 Favored Pre-proline 0 C--O 1.25 1.086 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.435 -162.78 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.6 Cg_endo -60.15 -19.62 57.66 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.754 2.303 . . . . 0.0 113.373 167.806 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.08 -77.29 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.466 179.519 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.58 -19.74 21.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.725 -163.256 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 16.2 t70 71.78 64.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.455 -170.403 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -126.08 -168.01 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.167 162.722 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -103.93 148.83 25.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.289 163.759 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 56.1 t -115.92 110.95 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.723 -164.036 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.496 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 27.0 t80 -72.74 154.95 40.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.374 -179.314 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.496 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 15.9 m-85 -60.28 -61.38 2.64 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.945 -158.568 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.78 -1.18 13.1 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.613 -173.015 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -102.4 12.17 36.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.547 178.046 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -97.11 158.19 15.56 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.178 -160.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.818 HG21 HD22 ' A' ' 28' ' ' LEU . 17.7 m -146.53 145.94 19.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.471 156.386 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -114.39 137.42 51.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.904 -1.043 . . . . 0.0 110.669 -166.117 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.0 t -178.35 127.48 0.12 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.235 -171.239 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 59.94 34.87 21.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.557 -170.172 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.75 18.0 51.51 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.541 -1.023 . . . . 0.0 110.541 169.313 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.44 153.15 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 164.674 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.427 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.68 177.17 6.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.289 -165.535 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 26.1 m95 -150.39 175.56 11.73 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.064 -1.425 . . . . 0.0 109.383 -177.705 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.8 m80 -93.37 137.64 32.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.526 171.144 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.56 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 ttp180 -61.03 -46.43 96.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.83 -170.693 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -50.36 -48.32 20.61 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.704 2.269 . . . . 0.0 113.496 166.867 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.77 -51.53 67.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.231 -166.376 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.818 HD22 HG21 ' A' ' 16' ' ' VAL . 3.2 tp -60.24 91.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.404 -162.13 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.7 mtpt -140.96 154.18 45.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.357 -169.372 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.0 t -69.45 132.05 45.72 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.376 176.809 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HB2' ' CZ ' ' A' ' 50' ' ' TYR . 45.1 mm-40 -95.43 31.31 2.01 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.194 -1.367 . . . . 0.0 110.261 173.437 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.33 -48.54 0.53 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.189 -174.343 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.1 p -114.1 -10.74 12.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.245 178.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.41 23.35 77.56 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 172.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -103.74 136.23 43.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.911 -0.645 . . . . 0.0 110.402 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 m -61.94 142.56 57.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.451 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.533 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 60.1 mt -99.92 157.77 16.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.422 -173.082 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -101.9 -172.39 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.221 -167.748 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER -60.98 -22.09 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.445 -167.59 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 174.68 60.76 0.05 OUTLIER Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 170.927 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -115.2 11.61 19.8 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 166.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.472 ' CE1' HD21 ' A' ' 28' ' ' LEU . 21.9 p-80 -102.04 -168.61 1.56 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.389 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.36 158.64 11.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.958 161.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.576 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -121.18 138.99 53.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.1 -163.632 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.446 ' CE1' ' HE1' ' A' ' 60' ' ' PHE . 57.8 t-80 -130.43 109.21 10.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.76 173.503 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.488 ' HB3' ' HD2' ' A' ' 48' ' ' LYS . 1.4 tp10 58.4 43.34 19.91 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.663 -170.463 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.84 22.65 73.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -117.64 98.43 51.7 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-N 115.159 -0.52 . . . . 0.0 109.759 173.195 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.7 Cg_endo -64.33 155.18 67.14 Favored 'Trans proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.62 2.213 . . . . 0.0 113.572 -173.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 31' ' ' GLU . 76.3 m-85 -151.6 177.63 10.15 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.001 175.431 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.0 m -56.52 132.08 50.46 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.379 -1.737 . . . . 0.0 110.426 161.979 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.64 -30.06 69.64 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.978 163.332 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.593 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 51.3 m80 -160.87 165.17 17.76 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.699 -1.137 . . . . 0.0 109.323 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.474 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.0 Cg_endo -72.89 -15.0 17.89 Favored 'Cis proline' 0 N--CA 1.483 0.898 0 C-N-CA 122.628 -1.822 . . . . 0.0 113.608 -13.394 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.6 m -59.54 -44.34 93.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.714 -157.02 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -61.78 -51.0 70.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.517 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.593 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -73.79 -15.25 61.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.342 -176.219 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.56 -56.03 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.354 173.421 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.3 tpt -72.1 -46.49 56.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.39 -170.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.446 ' HE1' ' CE1' ' A' ' 45' ' ' HIS . 18.0 m-85 -102.03 93.25 5.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.325 -171.665 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -138.02 141.26 11.94 Favored Glycine 0 CA--C 1.542 1.735 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -52.1 156.4 7.57 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.571 2.181 . . . . 0.0 113.555 -176.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' H ' ' HG3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.6 -54.4 2.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.321 169.785 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.6 -162.07 34.68 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -145.48 -80.39 0.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.364 -177.279 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.8 45.91 95.55 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 170.105 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.25 -80.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.195 -0.502 . . . . 0.0 110.356 -175.6 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.43 -88.63 0.65 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 170.337 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -163.77 169.23 38.66 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 -170.249 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.97 -14.55 15.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.152 -0.524 . . . . 0.0 110.311 176.136 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 58.59 -159.44 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.635 168.704 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.6 t 65.88 90.94 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.349 -168.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -157.41 79.79 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.379 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.0 p -96.16 -18.02 20.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.413 -178.052 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -111.23 -53.07 2.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.34 169.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.387 -170.008 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.437 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 8.7 Cg_exo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.5 0.538 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HD3' ' HG2' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -119.52 155.99 31.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.413 -167.414 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.0 t -83.7 119.42 73.64 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.417 -164.887 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.6 Cg_endo -62.0 -17.78 57.87 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.794 2.329 . . . . 0.0 113.261 167.547 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.485 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -83.27 -76.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.449 179.593 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -92.79 -20.25 20.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.825 -163.19 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 t0 72.46 59.51 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.468 -171.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.53 -176.35 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.993 160.725 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.416 ' HG2' ' HD3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -98.26 148.0 24.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.528 172.816 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.1 t -111.96 112.96 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.546 -158.53 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 19.1 t80 -73.14 151.44 41.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.41 -179.343 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.41 -54.63 43.34 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.875 -159.211 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.91 -1.22 27.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.522 -170.115 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 13.22 28.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.339 175.73 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.45 153.49 22.45 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.283 -165.921 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -147.84 147.57 17.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.787 156.721 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -113.84 136.06 53.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.666 -168.136 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.1 t -177.74 131.33 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.417 -173.614 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.607 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.1 mm? 60.12 36.0 21.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.719 -175.918 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.11 18.59 67.13 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.9 157.84 43.88 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 165.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.437 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 4.1 m-20 -89.78 176.7 6.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.29 -168.344 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -149.49 179.13 8.2 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.101 -177.041 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -96.27 142.99 27.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.445 170.66 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.568 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 15.0 tpt180 -61.28 -45.22 95.15 Favored Pre-proline 0 CA--C 1.543 0.689 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.728 -166.369 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.5 Cg_endo -64.81 -37.17 36.48 Favored 'Trans proline' 0 N--CA 1.483 0.893 0 C-N-CA 122.586 2.191 . . . . 0.0 113.604 175.107 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.485 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.4 m -61.08 -48.31 82.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.208 -166.35 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.63 HD21 ' CE1' ' A' ' 42' ' ' HIS . 6.6 tp -60.4 89.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.425 -163.319 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.513 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 mttt -143.46 144.06 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.3 -165.595 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.6 t -63.25 119.52 9.78 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.47 167.413 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 6.9 pt-20 -97.22 35.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.758 164.037 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HE2' ' HE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -120.35 -48.71 2.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.205 173.161 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -112.6 -22.71 10.63 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 114.541 -1.208 . . . . 0.0 110.994 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.27 42.81 9.06 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -178.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -97.65 133.63 41.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.364 169.773 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.503 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 14.0 m -69.06 143.17 54.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.313 167.847 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.828 HD13 ' HB2' ' A' ' 42' ' ' HIS . 85.0 mt -109.19 158.88 17.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.262 -167.478 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -116.74 -169.05 1.56 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.549 -166.149 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.9 t -60.84 -23.1 64.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 -165.554 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.88 70.69 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -136.27 22.45 3.39 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 163.907 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.828 ' HB2' HD13 ' A' ' 37' ' ' LEU . 31.6 p-80 -111.33 -168.43 1.31 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 114.792 -0.704 . . . . 0.0 110.486 -177.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -147.87 -166.64 2.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.776 165.661 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.607 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -163.13 137.81 6.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.077 162.624 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.403 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 58.3 t-80 -103.09 112.68 25.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.831 166.053 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 58.28 31.7 21.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.742 165.836 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 116.35 -20.12 12.66 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.579 -1.008 . . . . 0.0 110.579 170.041 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -104.92 94.21 7.3 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 121.408 0.623 . . . . 0.0 109.853 -169.175 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.3 Cg_endo -64.44 158.07 51.37 Favored 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.374 2.05 . . . . 0.0 113.597 -177.081 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 88.2 m-85 -155.4 -164.6 1.8 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.074 174.304 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 98.1 m -56.48 135.52 54.31 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.435 161.458 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -61.12 -30.92 70.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.885 161.69 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.536 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 29.8 m-70 -161.65 164.97 17.21 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.333 165.915 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.3 -15.24 16.79 Favored 'Cis proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.529 -1.863 . . . . 0.0 113.555 -14.679 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.68 -40.34 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.657 -156.645 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -60.98 -35.61 77.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.471 172.755 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.1 t -84.58 -13.54 51.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.338 -174.295 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.78 -40.52 13.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.229 -177.474 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.34 -47.01 7.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.451 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.403 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 16.2 m-85 -120.37 100.59 7.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.341 -169.562 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -147.44 -136.71 2.84 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.29 -20.94 4.04 Favored 'Trans proline' 0 N--CA 1.485 0.98 0 C-N-CA 122.511 2.141 . . . . 0.0 113.549 171.401 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -166.94 168.44 13.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.435 168.801 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.61 -142.6 3.43 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -169.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.1 -76.99 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.368 -0.416 . . . . 0.0 110.37 170.268 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 90.51 -85.05 1.33 Allowed Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 170.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.16 96.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.418 169.805 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.54 85.77 0.29 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 178.247 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 138.28 -64.63 0.55 Allowed Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 170.238 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.73 -82.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.443 -0.378 . . . . 0.0 110.315 -169.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.88 157.54 18.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.073 168.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.7 t -91.83 -68.99 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.323 -169.273 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -127.85 -173.03 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.406 -169.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.98 87.76 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.422 -170.092 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -118.63 100.29 7.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.344 170.026 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.291 -170.087 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.584 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 7.1 Cg_exo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 113.528 0.549 . . . . 0.0 113.528 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -147.05 136.47 22.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.485 -166.458 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -93.52 118.77 67.6 Favored Pre-proline 0 C--O 1.247 0.957 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.157 -167.741 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.66 -27.43 84.81 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.839 2.359 . . . . 0.0 113.196 168.779 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -73.02 0.19 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.388 -176.441 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.14 -16.2 22.77 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -165.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.23 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.569 -169.0 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 -167.82 1.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.01 158.332 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.31 145.58 30.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.379 165.984 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 48.5 t -107.71 110.25 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.746 -165.502 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -73.8 157.4 36.47 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -60.66 -63.13 1.4 Allowed 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.763 -160.007 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -3.83 19.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.372 -1.286 . . . . 0.0 111.79 -174.368 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.18 16.1 26.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 178.696 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -97.69 149.64 22.06 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.28 -163.543 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.781 HG21 HD22 ' A' ' 28' ' ' LEU . 12.5 m -142.2 119.07 6.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.483 154.683 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.7 m -88.05 133.36 33.99 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.287 -176.528 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.711 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.5 OUTLIER -160.9 120.67 2.69 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.337 -161.047 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.624 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.7 mm? 60.02 18.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.721 -177.641 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.21 -26.11 12.77 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 162.968 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.77 147.49 43.82 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.873 -0.663 . . . . 0.0 109.95 178.85 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -79.06 177.51 8.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.191 -163.264 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 46.2 m95 -151.46 -178.32 6.6 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 113.972 -1.467 . . . . 0.0 109.371 -177.339 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.1 m80 -98.49 145.59 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.488 171.86 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -62.62 -49.9 80.82 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.833 -173.512 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.7 Cg_exo -61.56 -32.28 87.69 Favored 'Trans proline' 0 N--CA 1.482 0.835 0 C-N-CA 122.744 2.296 . . . . 0.0 113.604 176.506 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -70.2 -49.49 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.149 -168.989 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.105 HD21 ' CE1' ' A' ' 42' ' ' HIS . 5.3 tp -64.51 82.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.329 -162.771 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -124.24 142.47 51.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.301 -170.074 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.6 t -63.24 128.62 36.67 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.37 170.533 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG3' ' HG2' ' A' ' 48' ' ' LYS . 4.9 mm-40 -95.81 37.32 1.22 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.159 169.626 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.38 -50.39 0.56 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.257 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -112.19 -18.75 12.48 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.043 -179.738 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.42 40.27 60.33 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 174.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -111.88 134.98 53.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.154 -0.523 . . . . 0.0 110.495 171.556 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 m -61.56 147.13 46.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.381 176.368 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 11.4 mt -109.23 170.25 8.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.355 -166.907 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 39' ' ' SER . 1.3 m -108.01 174.57 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.424 -165.404 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.442 ' H ' HG22 ' A' ' 38' ' ' THR . 7.1 t -64.98 69.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.371 171.118 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.71 55.42 1.65 Allowed Glycine 0 CA--C 1.531 1.045 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.3 12.84 5.74 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.589 -0.605 . . . . 0.0 111.589 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 1.105 ' CE1' HD21 ' A' ' 28' ' ' LEU . 34.4 p-80 -115.14 -168.93 1.46 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.781 -0.71 . . . . 0.0 110.257 -177.609 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.67 157.78 12.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.894 161.403 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.574 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.46 128.68 56.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.007 -163.851 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.459 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 57.1 t-80 -90.37 163.4 14.72 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.303 160.857 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.459 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 2.1 tt0 -60.43 92.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.119 -161.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.71 54.67 11.53 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.63 -169.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -179.74 101.84 0.18 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-O 121.451 0.643 . . . . 0.0 109.884 166.953 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.574 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.9 Cg_endo -65.1 150.25 88.06 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.803 2.335 . . . . 0.0 113.639 170.813 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 47.5 m-85 -147.61 -179.57 6.97 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.914 169.938 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.9 m -56.28 140.89 43.4 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.295 -1.775 . . . . 0.0 110.592 164.239 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -61.01 -32.95 72.52 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.12 168.426 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 45.0 m80 -162.73 165.63 14.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.339 166.362 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.472 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -71.5 -11.33 15.39 Favored 'Cis proline' 0 C--N 1.354 0.831 0 C-N-CA 122.52 -1.866 . . . . 0.0 113.616 -14.344 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.4 m -59.82 -45.75 91.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 -157.842 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -61.28 -65.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.275 -178.436 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.44 ' O ' ' HD3' ' A' ' 62' ' ' PRO . 73.1 m -65.27 -12.84 55.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.47 -170.237 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.58 -54.73 5.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.426 171.599 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -54.18 10.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.369 -169.258 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 45' ' ' HIS . 41.6 m-85 -114.17 99.42 7.61 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.327 -177.815 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.01 -61.63 0.19 Allowed Glycine 0 CA--C 1.542 1.741 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 172.566 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 57' ' ' SER . 8.0 Cg_exo -60.65 -7.06 6.59 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 122.56 2.173 . . . . 0.0 113.495 -169.887 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -17.64 56.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.375 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.93 143.59 0.13 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 169.79 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -159.29 -52.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.308 170.098 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 177.36 177.13 46.01 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 170.323 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -115.49 163.05 16.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.352 -0.424 . . . . 0.0 110.333 -170.134 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.87 174.45 51.35 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -170.234 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 148.62 -22.86 1.33 Allowed Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -170.403 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.54 -168.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.277 169.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -115.39 77.92 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.052 -168.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.58 97.62 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.253 -169.304 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -71.67 -35.7 70.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.421 179.054 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.1 p -67.12 -85.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.439 -170.225 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -158.54 -73.78 0.08 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.436 -169.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.655 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.316 178.21 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.88 148.12 49.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.36 -171.386 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.3 t -76.09 118.33 70.44 Favored Pre-proline 0 C--O 1.246 0.906 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.505 -163.469 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.601 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -60.22 -18.62 53.03 Favored 'Trans proline' 0 N--CA 1.489 1.21 0 C-N-CA 122.96 2.44 . . . . 0.0 113.211 167.295 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -84.99 -77.4 0.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.46 -178.14 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.8 p -89.87 -13.07 37.21 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.455 -167.231 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 60.2 54.59 3.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.574 -173.16 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.465 ' HA ' ' HD2' ' A' ' 8' ' ' LYS . 6.5 tptp -108.47 -168.37 1.35 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.767 157.081 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.96 155.3 18.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.595 161.527 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.7 t -114.24 113.28 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.504 -163.66 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.426 ' CE1' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t80 -73.35 157.79 36.3 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.359 177.076 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CE2' ' CE1' ' A' ' 11' ' ' TYR . 5.8 m-85 -60.55 -61.89 2.26 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.77 -159.819 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.38 -1.22 9.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.616 -173.22 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.557 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 15.8 mm-40 -101.96 12.98 36.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.69 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.24 152.12 18.64 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.277 -160.295 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.91 150.04 15.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.662 156.379 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 138.84 44.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.816 -170.677 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.453 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 27.8 t -177.3 132.76 0.17 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.341 178.007 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.634 HD23 ' OE1' ' A' ' 44' ' ' GLU . 3.4 mm? 60.15 38.0 20.51 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.533 -175.536 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.36 18.67 63.42 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 166.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -145.19 158.89 43.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.595 -0.302 . . . . 0.0 110.2 166.398 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.14 177.15 6.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.374 -167.729 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.601 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.84 -174.71 4.78 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 114.162 -1.381 . . . . 0.0 108.993 -177.991 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.0 m80 -100.9 142.38 32.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 113.803 -1.544 . . . . 0.0 110.555 170.136 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.6 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.23 -44.81 94.67 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.116 -174.211 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.6 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 6.0 Cg_endo -62.65 -28.65 77.03 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.503 2.135 . . . . 0.0 113.652 175.417 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.32 -50.85 11.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.294 -168.821 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.488 HD22 HG21 ' A' ' 16' ' ' VAL . 1.4 tp -65.2 75.78 0.05 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.301 -177.55 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 8.6 ttmt -147.52 139.54 24.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.431 -174.728 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.8 t -61.19 125.67 24.58 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.317 178.217 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HE1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -100.7 21.8 12.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.13 172.91 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.47 ' HD2' ' HE1' ' A' ' 59' ' ' MET . 0.0 OUTLIER -104.4 -58.6 1.86 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.162 166.063 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.404 ' HA ' ' HZ1' ' A' ' 32' ' ' LYS . 31.5 p -102.31 -33.34 9.63 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.407 -172.805 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.51 49.51 4.6 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.506 178.588 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.515 ' HB2' ' NZ ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -106.59 126.87 52.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.417 161.352 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.55 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 67.7 m -61.86 136.33 57.94 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.176 172.162 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 42' ' ' HIS . 34.3 mt -96.43 165.91 11.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.371 -160.726 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 39' ' ' SER . 2.0 m -112.12 177.93 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.296 -164.076 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 38' ' ' THR . 48.8 m -60.72 84.04 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.526 170.215 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 55.79 7.31 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 172.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -132.03 12.23 5.32 Favored Glycine 0 CA--C 1.524 0.651 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.608 162.665 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.563 ' CB ' HD13 ' A' ' 37' ' ' LEU . 32.7 p-80 -105.48 -168.53 1.47 Allowed 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 114.72 -0.74 . . . . 0.0 110.399 177.336 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.66 157.58 8.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.804 160.079 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.634 ' OE1' HD23 ' A' ' 19' ' ' LEU . 5.7 pt-20 -120.83 125.48 47.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.131 -161.576 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 83.4 t60 -93.4 164.65 13.12 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 158.178 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.472 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 15.3 mm-40 -58.09 93.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 -157.124 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.0 56.38 5.82 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.746 -172.313 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HE2' ' NZ ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER 179.14 98.86 0.17 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-O 121.755 0.788 . . . . 0.0 110.02 163.009 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.471 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 32.5 Cg_endo -68.52 137.84 40.41 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.974 2.449 . . . . 0.0 113.503 166.06 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.9 m-85 -133.85 -163.8 1.41 Allowed 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.67 171.383 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.9 m -56.37 134.16 53.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.451 163.521 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -60.93 -31.11 70.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.024 163.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.497 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 19.4 m-70 -158.62 166.39 16.57 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.206 164.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -66.26 -21.71 7.22 Favored 'Cis proline' 0 N--CA 1.49 1.276 0 C-N-CA 121.992 -2.087 . . . . 0.0 112.733 -20.726 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.9 m -56.54 -39.12 72.86 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.386 -152.821 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -64.73 -71.84 0.17 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.033 174.336 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.497 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 20.4 m -62.41 -14.16 37.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.54 -166.505 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.2 -50.92 5.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.236 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HE1' ' HD2' ' A' ' 32' ' ' LYS . 4.2 mtm -98.84 -34.07 10.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.505 -161.155 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.515 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -73.71 87.29 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.386 -166.31 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.492 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -176.48 48.42 0.11 Allowed Glycine 0 CA--C 1.546 1.987 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 172.323 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.492 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 10.6 Cg_endo -63.24 -86.13 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.672 2.248 . . . . 0.0 113.641 -168.381 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HE2' ' CZ ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER 64.84 -75.44 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.414 -166.11 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.12 119.41 0.01 OUTLIER Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -176.544 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.455 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 41.5 m-85 -111.08 26.21 10.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.444 -0.378 . . . . 0.0 110.282 -169.453 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.28 -65.52 0.5 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 169.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -23.34 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.27 -0.465 . . . . 0.0 110.439 -170.414 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.95 -140.45 6.6 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 179.266 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 104.75 -94.6 1.04 Allowed Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -171.006 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.511 ' HB1' ' OE2' ' A' ' 71' ' ' GLU . . . 61.62 117.29 0.02 OUTLIER 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.319 170.724 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.511 ' OE2' ' HB1' ' A' ' 70' ' ' ALA . 0.0 OUTLIER 59.09 130.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.734 178.136 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.4 p -108.61 117.9 35.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.336 -169.039 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -111.29 144.7 40.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.337 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.534 HG22 ' CE2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -61.14 -81.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.412 -169.755 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.534 ' CE2' HG22 ' A' ' 74' ' ' THR . 1.1 p90 -152.2 140.72 20.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.411 178.023 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.359 -170.014 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.491 0.535 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.4 149.0 47.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.29 169.488 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.1 t -83.55 117.27 68.17 Favored Pre-proline 0 C--O 1.249 1.047 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.221 -162.347 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.5 Cg_endo -59.46 -23.08 69.1 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.418 2.079 . . . . 0.0 113.069 169.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HG2' ' HD2' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -77.51 -72.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.545 -175.44 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.34 -20.45 19.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.755 -165.788 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.78 57.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.506 -172.882 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -118.57 -168.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.92 159.789 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -104.35 154.14 20.19 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.434 160.797 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 31.7 t -112.27 111.99 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.45 -162.21 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.57 33.1 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.554 -1.203 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -51.21 70.81 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.007 -156.453 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -0.37 29.33 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.444 -168.183 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -111.05 20.96 16.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.304 173.084 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.84 148.0 24.86 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.355 -169.717 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.95 117.53 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.661 154.256 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -97.34 142.58 29.04 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.521 -173.136 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.6 t -177.26 137.36 0.22 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.212 -169.268 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 4.7 mp 60.13 16.4 5.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.553 -172.874 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.6 -25.82 23.24 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 165.555 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.94 149.72 41.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 114.721 -0.739 . . . . 0.0 110.158 -178.135 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -85.76 177.53 7.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.217 -162.611 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 42.2 m95 -149.18 -175.84 5.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.376 179.27 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.6 m80 -98.22 148.52 23.52 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.468 173.389 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 tpp85 -61.58 -45.25 93.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.716 -168.689 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.0 Cg_endo -66.17 -40.28 15.87 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.538 2.159 . . . . 0.0 113.581 174.674 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.61 -53.26 59.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.301 -163.832 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 37' ' ' LEU . 1.6 tp -60.51 91.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.414 -163.015 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 mtmp? -152.18 148.05 27.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.353 -170.375 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.9 t -61.63 126.87 28.87 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.485 173.369 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.74 21.29 11.61 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.163 176.031 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.13 -61.25 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.358 165.952 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.0 p -100.54 -22.76 14.88 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.569 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.53 45.18 11.34 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.537 -1.025 . . . . 0.0 110.537 -175.842 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -99.99 120.98 40.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.463 . . . . 0.0 110.298 165.677 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.5 m -61.23 131.0 49.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.302 175.903 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 28' ' ' LEU . 21.3 mt -94.57 118.08 31.13 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 114.618 -1.173 . . . . 0.0 110.38 -174.024 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -60.15 -168.46 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.549 169.63 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -87.15 69.1 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.245 165.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 156.01 151.7 6.0 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.651 176.107 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.06 15.42 81.11 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.107 -1.044 . . . . 0.0 111.355 167.06 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.654 ' HB2' HD13 ' A' ' 37' ' ' LEU . 21.5 p80 -110.83 -166.51 1.08 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.722 -0.739 . . . . 0.0 110.853 172.343 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.452 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.95 159.63 9.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.191 -170.964 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.539 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -135.63 122.53 21.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.006 -165.092 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -128.86 102.15 6.41 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.197 -1.365 . . . . 0.0 109.972 177.037 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 58.6 47.47 13.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.643 -171.736 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.87 19.87 56.53 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.578 173.535 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HA ' ' HZ1' ' A' ' 5' ' ' LYS . 12.9 mmtm -110.4 98.38 35.92 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 170.347 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.616 ' HB2' HD12 ' A' ' 37' ' ' LEU . 9.7 Cg_endo -62.17 157.82 42.78 Favored 'Trans proline' 0 N--CA 1.486 1.042 0 C-N-CA 122.47 2.113 . . . . 0.0 113.638 -173.14 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 57.0 m-85 -158.32 173.55 16.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.994 -170.528 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.4 m -57.87 130.88 48.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.051 160.201 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -61.52 -31.91 71.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.81 160.718 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.481 ' CD2' ' CB ' ' A' ' 57' ' ' SER . 62.5 m80 -157.12 163.2 25.82 Favored Pre-proline 0 CA--C 1.553 1.076 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.162 165.07 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.428 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.71 -16.73 18.65 Favored 'Cis proline' 0 C--N 1.353 0.788 0 C-N-CA 122.665 -1.806 . . . . 0.0 113.651 -13.316 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.6 m -59.36 -44.99 92.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.711 -156.298 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -60.83 -52.73 63.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.507 174.456 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.481 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 7.6 t -63.31 -29.15 70.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.38 -173.421 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.09 20.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -170.524 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.8 mmt -101.49 -39.28 7.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.508 -171.201 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -113.06 81.65 1.53 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 178.008 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -136.64 -165.67 10.59 Favored Glycine 0 CA--C 1.542 1.725 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -172.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -61.51 73.07 0.09 OUTLIER 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.565 2.176 . . . . 0.0 113.597 -177.307 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.27 84.95 1.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.393 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.32 43.51 1.67 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 174.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.488 ' CZ ' ' NH1' ' A' ' 67' ' ' ARG . 0.1 OUTLIER 176.81 -170.04 0.07 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.332 -168.829 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.9 108.96 0.91 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 169.975 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.488 ' NH1' ' CZ ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER 179.54 98.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.371 -0.415 . . . . 0.0 110.366 -170.146 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 170.14 -124.28 1.13 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 170.402 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 76.97 119.52 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -170.324 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.38 -52.87 62.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.218 -170.042 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -117.92 -158.42 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.962 -169.167 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 p -111.44 -170.93 1.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.422 -167.377 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 18.1 m80 62.28 78.34 0.29 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.431 -170.24 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.0 m -150.36 -86.35 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.179 174.111 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -129.61 -79.49 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.19 165.049 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.564 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.344 165.158 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.466 ' H2 ' ' HD2' ' A' ' 2' ' ' LYS . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.946 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.55 158.2 22.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -168.619 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.8 t -86.84 122.75 71.3 Favored Pre-proline 0 C--O 1.247 0.972 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.165 -162.445 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.62 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -62.03 -30.18 82.59 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.846 2.364 . . . . 0.0 113.288 168.971 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -70.87 0.28 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.476 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -96.65 -14.22 22.27 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.485 -166.307 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.5 57.12 3.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.58 -169.362 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.71 -168.01 1.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.853 158.929 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -107.69 152.14 24.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.608 162.013 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.9 t -111.2 112.47 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.615 -163.636 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.35 152.98 44.65 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.308 175.596 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -60.52 3.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.777 -158.759 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.53 -11.8 61.05 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.744 -172.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.426 ' H ' ' HG2' ' A' ' 14' ' ' GLU . 3.9 pt-20 -102.81 42.6 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.173 170.984 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -108.82 152.72 24.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.384 -178.447 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.536 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -143.73 145.72 21.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.602 155.965 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.7 136.48 50.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.668 -166.204 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.422 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.0 t -177.99 136.45 0.17 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.466 -173.573 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.435 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.13 25.09 14.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.645 -177.671 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.75 -24.69 28.48 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 166.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 2' ' ' LYS . 3.3 tttp -118.09 165.98 13.11 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.752 -0.724 . . . . 0.0 110.21 -178.049 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.27 176.56 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.376 -166.293 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.62 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.4 m95 -148.53 -176.8 5.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 114.165 -1.379 . . . . 0.0 109.171 -178.882 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.932 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.4 m80 -102.98 141.83 35.11 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.473 169.309 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.96 -47.82 94.41 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.835 -174.549 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_exo -54.74 -27.3 51.43 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 C-N-CA 122.59 2.193 . . . . 0.0 113.609 172.624 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -83.38 -55.25 4.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.263 -167.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD21 ' CE1' ' A' ' 42' ' ' HIS . 3.4 tp -60.71 82.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.388 -171.126 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.75 144.9 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.393 -164.515 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.7 t -64.85 133.61 52.27 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.399 -171.281 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.34 25.42 6.28 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.439 175.143 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.476 ' HA ' ' NZ ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -130.68 -48.87 1.05 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.64 -179.597 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.8 p -109.68 -18.3 13.5 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.3 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.82 40.28 85.05 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 176.668 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.14 134.87 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.432 -0.384 . . . . 0.0 110.456 170.071 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.8 m -61.52 145.24 52.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.378 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.467 HD13 ' CB ' ' A' ' 42' ' ' HIS . 18.5 mt -106.9 143.31 35.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.398 -171.699 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -110.41 -169.45 1.47 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.523 -170.48 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.3 84.45 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 -167.476 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.87 55.52 4.12 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 167.39 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.58 12.28 4.58 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 167.919 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.551 ' CE1' HD21 ' A' ' 28' ' ' LEU . 28.5 p-80 -108.09 -170.36 1.67 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.135 -0.533 . . . . 0.0 110.498 -178.96 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -177.96 157.13 1.12 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.423 161.278 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.492 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -136.96 153.25 50.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.07 -157.889 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 10.3 p80 -98.2 167.66 10.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.551 157.25 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.84 86.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.123 -170.643 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.49 -48.77 0.71 Allowed Glycine 0 CA--C 1.529 0.916 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.566 -178.362 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 3.6 mttt -137.33 111.53 9.17 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 121.439 0.638 . . . . 0.0 109.764 -160.225 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.492 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 15.3 Cg_endo -68.91 154.11 71.49 Favored 'Trans proline' 0 N--CA 1.484 0.959 0 C-N-CA 122.963 2.442 . . . . 0.0 113.599 167.805 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -143.21 -167.82 2.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.827 163.777 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.1 m -56.56 140.24 47.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.34 -1.754 . . . . 0.0 110.453 164.044 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.66 -34.81 74.85 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 114.407 -1.269 . . . . 0.0 110.118 164.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.713 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 51.1 m80 -161.8 166.2 14.95 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.275 165.454 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.529 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.8 Cg_endo -71.81 -13.75 16.23 Favored 'Cis proline' 0 N--CA 1.481 0.783 0 C-N-CA 122.681 -1.8 . . . . 0.0 113.631 -12.309 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.1 m -59.68 -41.18 90.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.769 -157.194 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -61.17 -36.6 80.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.374 177.012 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.713 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -77.28 -28.48 53.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.342 -179.92 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.17 -45.32 7.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.317 -167.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.36 -34.41 75.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.354 170.995 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -96.51 29.28 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.298 172.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -170.11 56.8 0.19 Allowed Glycine 0 CA--C 1.544 1.853 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 171.304 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -59.36 133.1 50.19 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 C-N-CA 122.495 2.13 . . . . 0.0 113.561 -166.596 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.84 28.13 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.273 165.805 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.95 137.22 2.96 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 169.572 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 69.86 138.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.378 -0.411 . . . . 0.0 110.366 168.587 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 155.48 93.27 0.1 OUTLIER Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 170.346 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -158.88 -80.05 0.06 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.397 -0.401 . . . . 0.0 110.317 170.152 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.78 -169.23 54.95 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 169.98 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -120.7 97.31 0.64 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -170.082 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -161.78 -39.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.369 -0.416 . . . . 0.0 110.35 169.35 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 58.99 31.62 21.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.184 173.206 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 61.21 -163.93 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.331 169.249 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 71.8 129.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.453 -169.811 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.24 170.46 9.37 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.445 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 61.02 79.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.392 169.888 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.335 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.55 0.558 . . . . 0.0 113.55 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -125.5 153.53 43.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.458 -168.928 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.9 t -77.36 117.59 66.37 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.438 -163.813 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.0 Cg_endo -62.11 -9.92 16.31 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 123.001 2.467 . . . . 0.0 113.344 168.133 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.98 -74.38 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.446 -177.295 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -91.94 -19.35 22.54 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.973 -167.875 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.4 t0 72.3 49.17 0.23 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.594 -177.229 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -106.13 -168.39 1.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.839 159.325 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.1 mt-10 -107.03 157.49 17.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.457 158.565 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 25.4 t -114.49 112.5 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.252 -159.68 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -73.79 159.51 32.81 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.189 -179.507 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -60.21 -63.08 1.43 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.85 -158.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -2.98 15.1 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.661 -174.173 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -101.79 15.59 28.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.264 178.976 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.41 138.96 36.76 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.478 -163.398 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.2 m -132.72 117.71 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.523 154.178 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 46.6 m -89.79 133.05 34.91 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.209 -176.117 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -161.51 125.91 3.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.376 -159.759 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.857 HD23 ' HG2' ' A' ' 44' ' ' GLU . 5.5 mp 59.98 19.67 8.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.764 167.137 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 124.42 -31.43 4.42 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 162.469 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -135.42 158.98 43.01 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 114.653 -0.774 . . . . 0.0 110.082 -177.188 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.32 178.06 8.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.236 -164.568 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 40.2 m95 -151.38 -177.48 6.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 113.791 -1.549 . . . . 0.0 109.216 -178.767 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -99.63 147.83 24.96 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.485 171.799 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 10.6 mmt180 -61.16 -48.77 90.97 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.712 -168.827 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 3.6 Cg_exo -64.56 -36.19 44.15 Favored 'Trans proline' 0 N--CA 1.483 0.901 0 C-N-CA 122.618 2.212 . . . . 0.0 113.613 175.772 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.436 ' HA ' ' NZ ' ' A' ' 29' ' ' LYS . 1.6 m -64.59 -54.06 38.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -165.335 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.829 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -62.73 90.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.374 -166.088 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.0 OUTLIER -140.74 152.03 44.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.414 -171.355 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -64.27 128.66 36.77 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.293 171.866 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 6.3 tp10 -95.7 35.25 1.39 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.199 171.859 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.47 -52.08 0.7 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.9 p -109.77 -17.57 13.64 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.17 -178.247 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.26 33.43 44.46 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.68 137.11 32.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.275 -0.462 . . . . 0.0 110.414 171.492 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.2 m -66.45 137.3 56.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.309 167.772 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.545 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 28.4 mt -100.05 149.95 22.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.394 -167.304 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -89.62 -162.42 0.88 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.63 -173.288 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -95.71 36.69 1.26 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.355 -174.7 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.2 57.83 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 164.486 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.68 12.97 4.52 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 166.37 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.829 ' NE2' HD21 ' A' ' 28' ' ' LEU . 7.3 p80 -111.66 -169.01 1.38 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 114.621 -0.789 . . . . 0.0 110.657 178.838 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -169.55 159.39 8.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.995 164.679 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.857 ' HG2' HD23 ' A' ' 19' ' ' LEU . 16.7 pt-20 -113.96 132.99 55.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.009 -161.677 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.498 ' CE1' ' CD1' ' A' ' 56' ' ' TYR . 0.7 OUTLIER -90.41 74.95 6.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.231 174.056 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 58.37 40.95 23.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.903 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.47 21.11 35.63 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.524 -1.03 . . . . 0.0 110.524 177.146 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.42 95.86 46.54 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-O 121.248 0.547 . . . . 0.0 109.794 168.294 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.545 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 9.3 Cg_endo -64.26 152.86 79.59 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 C-N-CA 122.577 2.185 . . . . 0.0 113.63 -167.49 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 90.9 m-85 -153.94 173.12 16.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.886 173.323 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 75.8 m -56.96 133.18 54.58 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.408 163.592 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -61.25 -35.28 76.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.075 163.823 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m-70 -153.02 167.32 13.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.25 163.05 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.2 Cg_endo -66.83 -21.4 7.77 Favored 'Cis proline' 0 N--CA 1.488 1.179 0 C-N-CA 122.394 -1.919 . . . . 0.0 112.807 -17.245 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.4 m -56.73 -48.79 76.98 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.282 -153.866 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.498 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 10.1 t80 -60.98 -49.76 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.505 -178.735 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 25.0 p -72.06 -19.15 61.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.461 -175.921 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.02 -55.3 4.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.178 -167.356 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 tpt -96.26 -19.91 18.94 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.219 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.472 ' HB3' ' CD1' ' A' ' 56' ' ' TYR . 0.3 OUTLIER -131.4 -167.25 1.83 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.886 -156.684 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.84 100.99 0.26 Allowed Glycine 0 CA--C 1.542 1.721 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 -168.683 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' A' ' 57' ' ' SER . 2.9 Cg_endo -58.02 -32.01 94.34 Favored 'Trans proline' 0 N--CA 1.484 0.918 0 C-N-CA 122.654 2.236 . . . . 0.0 113.571 -177.072 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -77.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.366 -167.406 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 134.84 -116.23 1.55 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 171.09 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 69.05 -172.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.355 -0.423 . . . . 0.0 110.373 -169.711 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.42 -110.07 0.6 Allowed Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -170.757 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 ttp180 -60.98 168.9 2.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.363 -169.567 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 153.52 -24.34 0.75 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.201 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -60.99 145.44 48.28 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -170.166 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -149.94 -162.95 1.66 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.253 -169.833 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.56 167.13 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.66 -168.744 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 t -144.81 -164.26 1.88 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.355 -169.199 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.503 ' O ' HG22 ' A' ' 74' ' ' THR . 23.7 m-70 -100.37 138.13 37.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.364 -169.73 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.503 HG22 ' O ' ' A' ' 73' ' ' HIS . 3.2 t 60.47 35.28 20.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.909 175.02 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 70.64 143.37 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.285 170.856 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.597 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.371 170.162 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 113.516 0.545 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.96 134.39 44.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.419 -168.608 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 34.1 t -81.61 123.16 80.95 Favored Pre-proline 0 C--O 1.251 1.15 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.076 -165.304 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -63.8 -28.13 67.9 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 123.092 2.528 . . . . 0.0 113.25 169.852 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -70.61 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.415 -178.237 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -99.24 -26.08 14.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.716 -162.92 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.77 67.13 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.508 -167.58 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 6.9 tptp -125.51 -168.99 1.92 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.039 160.761 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -100.84 149.81 23.46 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.64 165.283 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.5 t -119.01 122.45 69.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.544 -163.518 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.529 ' HB3' ' HG3' ' A' ' 14' ' ' GLU . 26.9 t80 -88.36 152.09 22.16 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.387 -172.84 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HA ' ' HG3' ' A' ' 15' ' ' ARG . 90.4 m-85 -58.44 -59.51 5.24 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.468 -154.077 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -13.98 59.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.653 -174.166 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -107.1 42.87 1.23 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.563 164.923 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.917 ' HG2' HG12 ' A' ' 10' ' ' VAL . 11.6 mtt85 -99.75 170.59 8.45 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.128 161.351 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.674 HG21 HD22 ' A' ' 28' ' ' LEU . 19.8 m -150.08 149.06 14.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.524 153.892 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -115.13 136.8 52.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.841 -167.624 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 t -178.57 126.89 0.11 Allowed 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.991 -165.742 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 59.39 19.15 7.44 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.74 -170.629 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.7 -24.46 30.77 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 166.86 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -105.11 158.3 16.67 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.033 -0.584 . . . . 0.0 110.159 178.009 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -91.48 176.88 6.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.259 -166.873 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.563 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.1 m95 -153.15 166.34 32.81 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 114.016 -1.447 . . . . 0.0 109.149 -176.42 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -83.04 136.93 34.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.588 168.347 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.452 ' HG3' HG13 ' A' ' 16' ' ' VAL . 6.9 mtp180 -60.88 -43.81 92.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.95 -172.404 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -59.51 -37.15 90.81 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.596 2.197 . . . . 0.0 113.638 172.515 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.3 m -69.22 -47.62 64.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.161 -167.08 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.697 HD21 ' CE1' ' A' ' 42' ' ' HIS . 6.0 tp -60.6 86.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.391 -166.313 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.5 mtmm -145.46 142.17 29.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.367 -167.241 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -61.56 129.74 42.6 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.386 172.823 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -95.15 22.55 6.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.197 171.705 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 2.7 tptt -130.46 -35.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.464 -167.582 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.8 -17.78 5.78 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.342 171.789 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.46 41.45 51.79 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 177.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -109.11 136.97 47.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.437 172.384 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -61.04 148.37 40.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.472 177.817 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.2 mt -110.41 135.1 51.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.316 -168.012 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -93.46 -168.32 1.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.488 -167.091 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -60.66 -29.46 69.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.554 -164.976 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.82 62.03 0.1 Allowed Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -173.64 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.76 11.63 3.42 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.007 -0.596 . . . . 0.0 111.781 167.109 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.697 ' CE1' HD21 ' A' ' 28' ' ' LEU . 47.9 p-80 -106.83 -169.45 1.55 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.823 -0.689 . . . . 0.0 110.711 178.887 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.43 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -149.51 -166.91 2.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.586 164.685 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 8.4 pt-20 -133.03 135.68 45.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.405 166.865 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.511 ' HB2' ' CE2' ' A' ' 60' ' ' PHE . 56.0 t-80 -103.14 161.77 13.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 157.637 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.432 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 4.7 mt-10 -60.36 91.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.243 -159.429 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 136.91 -52.1 0.78 Allowed Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -174.616 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.0 144.52 35.51 Favored Pre-proline 0 C--O 1.242 0.695 0 CA-C-O 121.324 0.583 . . . . 0.0 109.939 -160.769 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.555 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -69.45 162.93 39.96 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.952 2.434 . . . . 0.0 113.675 169.527 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 94.2 m-85 -156.3 -170.76 3.46 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.913 166.274 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.1 m -58.0 130.47 46.69 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.755 -1.566 . . . . 0.0 110.117 163.666 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -60.64 -32.66 71.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.993 163.56 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 54.0 m80 -158.65 162.77 26.02 Favored Pre-proline 0 CA--C 1.551 0.991 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.254 162.731 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -73.61 -18.76 16.74 Favored 'Cis proline' 0 C--N 1.354 0.838 0 C-N-CA 122.651 -1.812 . . . . 0.0 113.829 -11.365 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.6 m -58.84 -43.08 90.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.961 -154.757 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -61.22 -60.19 4.14 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.32 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.411 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 36.7 t -65.4 -24.12 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.45 -173.518 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.9 -48.41 4.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.222 -166.847 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HE1' ' CZ ' ' A' ' 65' ' ' PHE . 46.8 mtp -104.0 -13.67 16.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.655 -161.334 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.511 ' CE2' ' HB2' ' A' ' 45' ' ' HIS . 4.6 m-85 -82.54 79.32 9.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.095 163.498 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.14 81.84 0.03 OUTLIER Glycine 0 CA--C 1.544 1.894 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 -167.187 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -52.46 -177.48 0.03 OUTLIER 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.47 2.113 . . . . 0.0 113.555 -166.184 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 tptm 63.92 113.83 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.371 -178.052 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 103.37 73.81 0.98 Allowed Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 169.014 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CD2' ' N ' ' A' ' 66' ' ' GLY . 64.8 t80 173.22 162.37 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.568 . . . . 0.0 110.397 175.755 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.474 ' N ' ' CD2' ' A' ' 65' ' ' PHE . . . 107.11 -109.61 3.07 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 168.391 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -61.09 146.15 48.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.463 -0.368 . . . . 0.0 110.319 -168.633 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 150.6 45.31 0.02 OUTLIER Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 170.191 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -119.91 -144.37 7.2 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -170.008 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.62 138.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.09 0.472 . . . . 0.0 110.399 -173.474 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -62.07 100.65 0.17 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.011 -169.39 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.71 -42.91 0.44 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.446 177.484 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.43 163.1 7.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.495 179.533 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.08 -60.87 0.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.4 -169.812 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 66.3 -76.31 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.356 -169.58 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt . . . . . 0 C--O 1.241 0.62 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.469 169.841 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.965 0 N-CA-C 113.588 0.572 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.68 157.35 28.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.453 -169.658 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.8 t -84.08 118.07 70.32 Favored Pre-proline 0 C--O 1.25 1.106 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.166 -162.279 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -60.03 -21.88 67.06 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.625 2.217 . . . . 0.0 113.106 170.051 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.48 -74.3 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.343 -176.647 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.37 -20.82 19.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.665 -165.111 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.8 t0 72.24 56.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.453 -171.463 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -116.45 -167.86 1.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.999 160.879 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.49 149.35 26.28 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.259 163.274 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -110.2 111.2 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.636 -164.785 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -78.81 163.73 25.1 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.318 179.831 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -60.52 -63.53 1.27 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.724 -159.48 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.19 -10.95 60.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.785 -174.534 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.6 44.3 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.238 170.657 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.55 141.44 47.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.607 -177.742 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.568 HG21 HD22 ' A' ' 28' ' ' LEU . 11.5 m -136.8 117.47 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.283 151.596 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -88.82 133.07 34.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.249 -175.936 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.7 121.37 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.435 -159.661 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HG3' ' A' ' 44' ' ' GLU . 5.5 mp 59.87 27.12 16.41 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.8 166.787 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.03 19.17 29.44 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 162.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -171.09 154.57 4.12 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 164.694 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.7 OUTLIER -80.15 176.68 9.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.261 -163.562 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.1 m95 -151.86 -176.12 5.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.353 -176.812 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -100.75 146.7 26.91 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.479 171.489 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.8 tpp85 -63.53 -47.31 83.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.831 -169.524 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -62.95 -31.45 77.07 Favored 'Trans proline' 0 N--CA 1.483 0.912 0 C-N-CA 122.525 2.15 . . . . 0.0 113.612 175.661 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -70.1 -43.94 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.188 -165.909 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.568 HD22 HG21 ' A' ' 16' ' ' VAL . 5.5 tp -69.04 77.59 0.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.27 -164.253 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 4.7 mtmt -137.44 149.65 47.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.412 -166.284 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -69.76 127.55 33.33 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.45 -178.517 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.65 18.35 20.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.712 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 55' ' ' CYS . 19.4 mmmt -101.3 -60.16 1.57 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.356 162.215 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.3 p -103.65 -35.9 8.09 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 -167.538 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 90.28 49.73 3.18 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 179.149 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.775 ' HE3' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -105.25 142.0 35.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.389 160.817 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.488 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 90.4 m -69.08 151.96 45.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.262 167.059 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.775 HD23 ' HE3' ' A' ' 35' ' ' LYS . 19.1 mt -116.94 156.92 26.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.26 -169.535 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -104.28 -168.21 1.46 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.627 -173.375 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.0 p -60.85 -26.38 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.547 -166.121 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.22 65.98 0.12 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -172.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.78 16.61 2.41 Favored Glycine 0 CA--C 1.521 0.443 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 168.506 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.716 ' HB2' HD13 ' A' ' 37' ' ' LEU . 10.3 p80 -111.93 -169.35 1.45 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.632 -177.286 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.413 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -144.24 -164.0 1.8 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.557 165.364 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -167.05 157.27 11.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.307 163.062 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.527 ' CE1' ' HH ' ' A' ' 50' ' ' TYR . 33.6 p80 -134.08 123.34 24.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.321 162.854 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 58.32 37.68 25.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.906 -178.841 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.09 23.15 69.51 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 165.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.64 99.95 25.92 Favored Pre-proline 0 C--O 1.244 0.784 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 168.672 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.8 Cg_endo -67.69 168.28 18.83 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.524 2.149 . . . . 0.0 113.614 -172.385 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HH ' ' CE1' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -152.98 -165.04 2.08 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.075 166.252 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.1 m -56.85 131.12 48.53 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.141 -1.39 . . . . 0.0 110.258 161.826 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -33.08 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.845 160.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.532 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 62.8 m80 -156.66 163.68 24.18 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.23 163.591 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.85 -17.63 18.09 Favored 'Cis proline' 0 N--CA 1.481 0.757 0 C-N-CA 122.705 -1.79 . . . . 0.0 113.631 -12.019 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.3 m -59.35 -44.03 92.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.796 -155.778 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.98 -54.39 45.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.467 178.161 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.532 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -72.7 -35.24 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.323 -169.296 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.36 -47.96 58.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.36 -177.086 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.2 tpp -77.01 -34.76 57.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.442 -170.066 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -65.95 82.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.306 -171.055 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.477 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 146.71 63.66 0.01 OUTLIER Glycine 0 CA--C 1.543 1.808 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -176.151 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.477 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 1.6 Cg_endo -56.61 146.31 76.65 Favored 'Trans proline' 0 N--CA 1.486 1.058 0 C-N-CA 122.396 2.064 . . . . 0.0 113.464 172.925 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.3 147.28 20.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.346 168.61 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.08 -59.48 3.51 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 170.599 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -82.3 111.74 18.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.283 -0.458 . . . . 0.0 110.182 -169.999 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.93 -122.44 1.87 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 170.196 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 63.37 108.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.299 170.158 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -95.75 -124.06 4.35 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 170.21 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 179.89 96.21 0.1 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 170.265 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.24 139.93 30.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.341 -170.242 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 58.56 102.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.597 168.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.9 p -82.74 -84.53 0.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.432 169.985 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -127.68 -43.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.368 -169.372 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.6 p -145.55 118.33 8.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.38 170.54 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.69 92.64 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.322 -178.361 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? . . . . . 0 C--O 1.241 0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.385 -173.536 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.522 ' HD2' ' HD3' ' A' ' 21' ' ' LYS . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.076 0 N-CA-C 113.486 0.533 . . . . 0.0 113.486 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -126.22 159.61 32.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.409 -171.225 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -86.08 119.27 71.62 Favored Pre-proline 0 C--O 1.249 1.046 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.199 -167.228 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -59.4 -23.75 71.67 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.655 2.237 . . . . 0.0 113.19 169.552 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -73.21 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.409 -178.53 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -97.69 -21.59 16.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.712 -161.887 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 73.42 67.18 0.1 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.559 -170.404 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.13 -171.19 2.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.102 159.618 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -102.22 154.94 18.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.757 166.232 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.907 HG22 ' NE2' ' A' ' 24' ' ' HIS . 59.1 t -124.19 112.03 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.828 -160.845 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.484 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.3 t80 -73.83 164.79 26.17 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.376 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -60.74 -56.93 15.32 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.798 -160.477 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.93 59.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.438 -1.255 . . . . 0.0 111.621 -174.311 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.646 ' O ' HG13 ' A' ' 10' ' ' VAL . 6.3 pt-20 -111.2 37.81 2.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.965 163.921 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.806 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -119.33 131.23 55.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.039 164.135 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.425 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 29.1 m -109.58 178.51 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.525 156.718 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.67 142.61 51.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.662 -176.461 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.423 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.6 t -177.77 136.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.376 170.545 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.08 29.12 18.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.593 -173.481 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.41 18.15 73.19 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 168.259 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HD3' ' HD2' ' A' ' 1' ' ' PRO . 9.0 mmtp -142.86 150.97 40.57 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 164.52 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 1.1 m-20 -81.3 178.33 8.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.314 -164.102 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.3 m95 -151.08 160.18 44.05 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.4 -179.347 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.907 ' NE2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -78.19 136.21 37.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.365 166.27 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.79 -43.86 93.19 Favored Pre-proline 0 CA--C 1.545 0.763 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.786 -170.87 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.0 Cg_endo -64.07 -23.79 67.04 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.351 2.034 . . . . 0.0 113.604 175.71 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.38 -45.62 21.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.313 -173.086 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.562 HD23 ' HB2' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -73.23 91.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.907 . . . . 0.0 110.346 -170.19 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.566 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 5.1 mtmt -152.6 141.56 21.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.385 -167.591 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -61.79 126.26 26.73 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.471 171.14 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.56 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 13.4 tp10 -97.21 20.32 11.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 170.942 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -107.36 -62.34 1.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.189 165.86 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.6 p -102.46 -19.17 15.02 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.776 -168.39 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.39 34.92 30.96 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.306 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -88.83 126.9 35.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.307 169.524 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.566 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 94.4 m -60.91 135.6 57.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.211 163.831 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 42' ' ' HIS . 81.2 mt -99.49 104.43 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.387 -163.528 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -111.1 -168.63 1.33 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.395 -169.123 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 40.5 t 58.63 -89.02 0.02 OUTLIER 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.731 162.261 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.96 47.32 0.07 OUTLIER Glycine 0 CA--C 1.529 0.931 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 159.35 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -116.28 20.2 12.72 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -163.175 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.652 ' HB3' HD22 ' A' ' 37' ' ' LEU . 38.2 p-80 -101.4 -169.57 1.71 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.916 -0.642 . . . . 0.0 110.711 177.011 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -175.41 159.51 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.14 167.803 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.446 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -117.62 137.45 52.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.068 -162.495 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 57.2 t-80 -117.81 116.12 26.36 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 158.75 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 1.4 mt-10 60.74 -148.04 0.44 Allowed 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.439 -151.343 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.56 36.36 3.86 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 165.686 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -109.55 88.33 6.19 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-O 121.241 0.544 . . . . 0.0 109.786 171.757 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.3 Cg_endo -65.89 154.2 74.93 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.493 2.128 . . . . 0.0 113.58 -176.496 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 7.8 m-85 -148.16 -165.81 2.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.795 164.886 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 80.5 m -59.22 135.82 57.76 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.938 161.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -60.33 -34.72 74.22 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.254 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.9 m-70 -156.09 172.85 5.52 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.313 164.162 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.0 Cg_endo -63.35 -18.02 5.2 Favored 'Cis proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.431 -2.32 . . . . 0.0 112.533 -22.263 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.8 m -57.19 -45.2 83.93 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.221 -154.644 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -60.88 -49.03 79.11 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.317 -174.328 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.413 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -68.84 -42.24 77.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.495 178.145 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.72 -50.36 30.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 -170.216 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.466 ' CG ' ' HD3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -61.04 -60.09 4.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.439 -179.741 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.502 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 1.3 m-85 -60.73 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.387 -161.969 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.33 103.11 0.24 Allowed Glycine 0 CA--C 1.545 1.959 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 175.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -49.15 90.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 122.668 2.246 . . . . 0.0 113.535 -163.635 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 63' ' ' LYS . 18.9 mmtt 66.34 -78.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.552 165.919 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.03 86.29 0.06 OUTLIER Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -165.491 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 61.1 -169.31 0.17 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.122 0.487 . . . . 0.0 110.334 167.548 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.81 58.8 0.35 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.36 -1.096 . . . . 0.0 110.36 169.979 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.39 83.99 2.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.971 -0.615 . . . . 0.0 110.432 -179.022 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.33 132.85 10.58 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -170.057 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -68.36 -62.7 3.98 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 169.626 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.21 79.99 0.23 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.381 -0.409 . . . . 0.0 110.253 169.421 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -117.31 -18.16 9.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.075 -168.831 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.7 t -140.07 93.49 2.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.331 169.524 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 67.3 -80.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.41 169.561 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.61 HG22 ' H ' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -124.5 -178.88 4.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.472 -169.825 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.61 ' H ' HG22 ' A' ' 74' ' ' THR . 24.3 m-85 -85.82 168.56 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.383 -170.081 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? . . . . . 0 C--O 1.24 0.58 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.296 169.994 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.72 150.77 51.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.391 -168.958 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.4 t -84.47 117.6 69.11 Favored Pre-proline 0 C--O 1.25 1.127 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.253 -164.201 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.16 -20.08 66.33 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 C-N-CA 122.784 2.322 . . . . 0.0 113.254 170.056 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.501 ' HG3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -78.97 -73.48 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.464 -177.543 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.61 -21.98 18.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.527 -164.487 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 72.55 64.56 0.12 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.501 -169.061 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -125.38 -168.58 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.083 161.465 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.66 151.63 23.46 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.592 161.922 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 33.9 t -112.21 112.57 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.494 -161.296 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.78 151.43 35.98 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.251 179.381 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -60.22 -49.38 77.86 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.007 -158.398 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.3 -0.78 33.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.472 -167.487 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -104.24 4.39 33.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 174.378 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.57 152.88 33.77 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.312 -160.811 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 28' ' ' LEU . 21.7 m -150.29 136.8 12.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.754 159.116 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.9 m -113.19 135.11 54.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.505 -165.603 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.59 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 22.4 t -178.01 136.01 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.536 -165.692 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 60.14 21.64 10.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.593 -174.42 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 16.89 79.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 169.407 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 158.84 43.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 163.15 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.06 176.84 7.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.249 -164.816 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 30.9 m95 -150.13 179.94 7.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 113.983 -1.462 . . . . 0.0 109.227 -179.275 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 41.8 m80 -96.03 150.88 19.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.425 166.559 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.583 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -61.48 -58.91 15.42 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.875 178.336 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 13.3 Cg_endo -54.28 -22.79 27.62 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 122.188 1.925 . . . . 0.0 113.619 -177.426 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.501 ' HB3' ' HG3' ' A' ' 5' ' ' LYS . 8.0 m -81.45 -53.97 5.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.382 -172.247 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.917 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -63.71 93.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.482 -161.843 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -142.49 146.67 34.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.408 -176.79 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -60.09 126.51 27.82 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.541 174.287 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.499 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 1.2 tt0 -94.75 27.7 2.97 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.104 172.116 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -124.19 -55.8 1.66 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.468 173.668 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.9 p -107.4 -21.8 12.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.832 -172.546 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.96 51.42 23.97 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -171.348 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 tptm -98.05 123.47 42.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.14 163.566 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.4 m -61.43 133.46 55.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.118 170.096 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.455 HD13 ' HB2' ' A' ' 42' ' ' HIS . 94.8 mt -98.2 138.03 36.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.426 -161.733 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 40' ' ' GLY . 68.7 m -60.42 150.28 31.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.268 165.406 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.0 t -64.84 65.9 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.63 162.204 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 38' ' ' THR . . . 138.69 150.04 5.54 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.527 -164.536 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.82 14.74 82.05 Favored Glycine 0 C--N 1.344 0.986 0 C-N-CA 119.934 -1.127 . . . . 0.0 111.37 171.926 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.917 ' CE1' HD21 ' A' ' 28' ' ' LEU . 51.9 p-80 -120.11 -167.03 1.37 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 113.993 -1.104 . . . . 0.0 110.809 175.141 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -156.66 -165.63 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.899 -173.442 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.4 172.76 5.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.99 164.206 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.474 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 34.4 p80 -130.83 104.73 7.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.353 162.406 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 58.45 42.8 20.56 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.884 177.023 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 110.67 -18.91 26.65 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 166.948 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -98.73 101.11 11.01 Favored Pre-proline 0 C--O 1.243 0.752 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 -170.934 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 10.6 Cg_endo -65.82 157.99 56.08 Favored 'Trans proline' 0 N--CA 1.487 1.109 0 C-N-CA 122.472 2.115 . . . . 0.0 113.533 -171.059 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 62.8 m-85 -152.45 -176.75 5.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.052 169.964 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 71.3 m -57.42 134.2 55.83 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.029 158.908 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 5.8 t30 -69.47 -29.5 67.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.761 160.699 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.9 m-70 -153.59 161.03 30.21 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.153 164.546 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 10.0 Cg_endo -73.62 -16.79 18.45 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 122.685 -1.798 . . . . 0.0 113.675 -12.516 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -59.4 -53.45 58.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.752 -156.161 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -61.03 -48.1 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.5 178.762 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.1 p -65.53 -21.21 66.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.33 -176.762 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . -84.18 -52.41 6.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.16 -168.661 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -106.82 -33.29 7.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.363 -174.89 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -90.93 -170.53 2.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.299 167.205 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -119.3 152.33 17.26 Favored Glycine 0 CA--C 1.543 1.818 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -173.252 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -59.04 140.39 95.06 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.363 2.042 . . . . 0.0 113.628 -178.55 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.86 -18.92 19.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.417 170.141 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.86 178.49 3.42 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -169.408 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -67.16 -172.95 0.23 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.474 -169.509 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 175.57 82.47 0.06 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 170.071 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -173.01 174.2 3.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.415 170.152 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -172.27 166.02 38.74 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 -170.229 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.99 -133.58 1.96 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 170.399 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.2 115.55 30.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.365 -0.418 . . . . 0.0 110.305 -169.907 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.4 138.99 57.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.009 -168.834 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.89 162.22 33.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.394 -169.379 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.489 ' O ' HG22 ' A' ' 74' ' ' THR . 5.8 m80 -64.6 -23.98 67.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.38 169.943 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 73' ' ' HIS . 3.2 t 60.45 39.19 18.7 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.908 175.124 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 70.57 -76.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.233 -174.458 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 pttt . . . . . 0 C--O 1.24 0.566 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.432 -170.046 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.587 ' H2 ' ' HD3' ' A' ' 2' ' ' LYS . 5.4 Cg_exo . . . . . 0 N--CA 1.485 0.991 0 N-CA-C 113.503 0.54 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.587 ' HD3' ' H2 ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -135.09 132.26 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.414 -175.191 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.9 t -80.68 121.69 81.44 Favored Pre-proline 0 C--O 1.251 1.134 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.029 -162.66 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -63.43 -27.13 70.63 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 C-N-CA 122.957 2.438 . . . . 0.0 113.311 174.256 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -73.3 0.25 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.288 -179.178 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.5 p -91.95 -22.86 19.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.748 -160.998 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.6 t0 72.39 67.74 0.13 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.482 -169.809 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.0 OUTLIER -127.17 -168.77 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.156 162.155 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 152.93 22.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.601 162.254 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 74.9 t -122.04 110.46 27.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.945 -163.765 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -73.32 162.54 29.23 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.423 -178.666 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.486 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.7 OUTLIER -60.97 -55.73 29.52 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.822 -161.594 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.48 -9.25 59.57 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.579 -174.195 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.536 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 2.2 mt-10 -112.49 35.79 3.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.129 163.38 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.799 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -119.08 136.39 54.17 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.097 165.253 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.696 HG21 HD22 ' A' ' 28' ' ' LEU . 16.1 m -123.76 135.56 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.514 156.42 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 3.4 m -103.57 138.43 40.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.485 -170.685 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.491 ' C ' HD22 ' A' ' 19' ' ' LEU . 5.1 t -170.39 131.39 0.94 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.383 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.643 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.99 17.58 6.79 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.571 -173.355 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.81 -25.37 22.82 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 165.35 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 148.52 43.62 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.773 -0.714 . . . . 0.0 110.232 -178.27 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -81.78 177.6 8.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.17 -164.071 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.9 m95 -151.09 163.81 37.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.048 -1.433 . . . . 0.0 109.377 -177.147 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -84.6 140.11 31.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.593 170.426 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' CG ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.26 -44.21 92.55 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.961 -167.524 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD3' ' CG ' ' A' ' 25' ' ' ARG . 9.1 Cg_exo -51.96 -47.73 25.11 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.752 2.301 . . . . 0.0 113.424 166.446 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 m -63.95 -46.01 86.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.467 -165.717 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.95 HD21 ' CE1' ' A' ' 42' ' ' HIS . 1.6 tp -62.4 92.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -169.993 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.586 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 9.7 mtpm? -143.3 140.08 30.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.392 -170.111 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 10.7 t -60.23 129.11 40.07 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.448 171.363 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -98.81 39.78 1.24 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.095 -1.412 . . . . 0.0 110.242 172.458 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -143.23 -43.8 0.29 Allowed 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.362 -175.674 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.2 p -115.25 -19.05 10.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.006 173.685 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.84 41.78 54.9 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 179.41 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.402 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.86 133.56 44.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.315 169.667 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.2 m -60.74 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.299 168.461 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.865 HD13 ' HB2' ' A' ' 42' ' ' HIS . 96.5 mt -97.9 132.62 43.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.308 -164.82 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -106.03 -168.67 1.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.524 -166.246 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.6 t -60.91 89.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.433 -165.067 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.57 55.45 20.34 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 163.825 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.5 21.55 2.73 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 164.537 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.95 ' CE1' HD21 ' A' ' 28' ' ' LEU . 46.3 p-80 -115.17 -166.9 1.16 Allowed 'General case' 0 CA--C 1.524 -0.057 0 CA-C-N 114.92 -0.64 . . . . 0.0 110.581 -176.747 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -161.4 -164.46 1.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.706 -169.452 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.4 148.89 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.177 163.065 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 50' ' ' TYR . 1.6 p-80 -91.13 165.35 13.54 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.458 157.051 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.68 87.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.1 -167.832 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 145.16 -61.5 0.49 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.581 -1.007 . . . . 0.0 110.581 -169.149 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.33 142.34 41.13 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-O 121.693 0.758 . . . . 0.0 109.78 -162.108 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.586 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 13.6 Cg_endo -72.42 158.31 51.56 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.865 2.377 . . . . 0.0 113.757 173.697 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 34.2 m-85 -147.0 178.01 8.69 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.946 168.74 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -56.44 140.44 45.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.474 163.25 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -60.66 -34.26 74.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.111 165.202 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 48.6 m80 -162.63 166.42 13.73 Favored Pre-proline 0 CA--C 1.552 1.019 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.331 165.556 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -71.91 -13.15 16.54 Favored 'Cis proline' 0 C--N 1.353 0.774 0 C-N-CA 122.745 -1.773 . . . . 0.0 113.569 -12.7 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.8 m -59.82 -41.26 90.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.68 -157.286 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.547 ' CE2' ' HB3' ' A' ' 62' ' ' PRO . 10.9 t80 -61.06 -38.2 85.36 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.367 176.856 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.581 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 17.1 t -75.77 -18.19 59.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.464 176.503 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.32 -54.14 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.143 -168.79 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.8 mmm -103.18 -25.16 13.47 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.338 -175.227 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -117.05 -170.29 1.81 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.258 167.829 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -138.0 102.43 0.37 Allowed Glycine 0 CA--C 1.544 1.844 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.35 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.581 ' HD3' ' HA ' ' A' ' 57' ' ' SER . 1.6 Cg_endo -54.65 -60.33 0.62 Allowed 'Trans proline' 0 N--CA 1.487 1.089 0 C-N-CA 122.451 2.101 . . . . 0.0 113.502 -169.851 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 pttp 58.41 19.71 6.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.596 174.454 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.92 -121.44 4.34 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -171.01 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -76.6 -178.38 4.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.433 -0.384 . . . . 0.0 110.357 -168.85 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.37 -167.15 28.55 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 170.42 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 65.47 116.48 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.284 -0.458 . . . . 0.0 110.432 169.672 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.78 157.43 7.92 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 169.214 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.4 171.51 12.97 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 169.99 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.93 114.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.241 169.592 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 58.56 110.51 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.631 167.965 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.0 p -104.22 -164.26 1.04 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.36 168.735 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.0 179.93 4.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.342 170.063 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.7 p -144.69 25.04 1.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.452 -170.036 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -89.04 -64.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.332 -176.604 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.8 tptt . . . . . 0 C--O 1.24 0.601 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.372 170.083 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.461 ' CD ' ' HE2' ' A' ' 21' ' ' LYS . 5.6 Cg_endo . . . . . 0 N--CA 1.486 1.03 0 N-CA-C 113.562 0.562 . . . . 0.0 113.562 . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 28.9 mttp -133.53 156.63 47.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.455 170.591 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.3 t -86.1 123.28 72.0 Favored Pre-proline 0 C--O 1.25 1.128 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.167 -164.355 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.619 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -62.65 -30.31 78.68 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.808 2.338 . . . . 0.0 113.164 169.424 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -69.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.495 -175.313 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -98.33 -22.58 16.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 -165.178 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.9 59.68 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.52 -171.543 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.458 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -124.59 -172.06 2.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.142 159.2 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -100.76 153.1 19.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.7 168.803 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -118.12 113.46 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.74 -164.261 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.545 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 34.9 p90 -82.17 163.88 21.64 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.359 -178.095 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.541 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 m-85 -58.12 -59.5 5.2 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.26 -153.288 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.35 -11.24 59.81 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.698 -174.615 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.677 ' O ' HG13 ' A' ' 10' ' ' VAL . 14.4 mt-10 -108.2 46.2 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.807 164.32 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' HD2' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -118.59 141.34 48.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.699 161.91 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -136.81 131.52 47.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.712 157.695 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 34.3 m -97.98 144.19 27.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.481 -164.531 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.8 t -171.39 130.11 0.72 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.43 -171.035 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.17 15.08 4.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.698 -168.577 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.19 -24.58 31.57 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 170.661 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.461 ' HE2' ' CD ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -110.98 140.31 45.6 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 114.806 -0.697 . . . . 0.0 110.091 -178.897 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 5.6 m-20 -77.77 177.92 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.212 -161.299 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.619 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 31.7 m95 -150.59 171.15 17.56 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 113.82 -1.536 . . . . 0.0 109.279 179.739 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.4 m80 -88.75 149.14 23.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.506 174.925 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 tpp180 -61.32 -45.73 95.01 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.876 -170.975 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -64.24 -34.89 54.54 Favored 'Trans proline' 0 N--CA 1.484 0.956 0 C-N-CA 122.582 2.188 . . . . 0.0 113.601 174.378 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.31 -47.4 61.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.216 -164.926 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.086 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.5 tp -61.72 83.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.296 -168.444 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -144.88 152.0 39.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.442 -165.567 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -70.05 138.67 52.3 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.459 -177.777 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG3' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -89.65 -23.31 21.93 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.735 174.555 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.553 ' HD2' ' HE3' ' A' ' 59' ' ' MET . 2.2 tptp -71.08 -64.63 0.87 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.957 172.81 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.1 p -108.47 -19.79 13.33 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.965 -159.493 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.73 42.82 53.1 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 177.627 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -100.19 136.52 39.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.346 166.3 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 m -60.69 146.19 46.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.323 170.891 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 96.5 mt -110.38 153.05 25.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.288 -163.231 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 39' ' ' SER . 14.5 m -105.83 170.29 7.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.452 -163.569 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.581 ' H ' HG22 ' A' ' 38' ' ' THR . 4.5 t -61.64 -17.67 56.31 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.459 -168.344 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.91 57.19 0.14 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.97 11.61 3.63 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 114.917 -0.642 . . . . 0.0 111.753 166.889 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 1.086 ' CE1' HD21 ' A' ' 28' ' ' LEU . 4.6 p-80 -111.11 -169.8 1.52 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.144 0.497 . . . . 0.0 111.007 -177.662 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' N ' ' CD2' ' A' ' 42' ' ' HIS . . . -154.24 -165.14 2.01 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.871 167.949 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.508 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.84 158.41 4.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.126 171.516 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.422 ' N ' ' HG2' ' A' ' 44' ' ' GLU . 10.1 p80 -123.2 172.76 8.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.957 157.947 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -61.42 91.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.192 -163.906 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.65 -65.77 0.34 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -169.181 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HD2' ' CE2' ' A' ' 50' ' ' TYR . 2.6 pttp -152.89 138.98 12.07 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-O 121.91 0.862 . . . . 0.0 109.961 -163.501 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.594 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 20.5 Cg_endo -69.28 170.01 16.98 Favored 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.934 2.422 . . . . 0.0 113.572 170.127 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -153.64 -164.99 2.02 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.908 162.859 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 89.0 m -57.19 136.82 56.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.259 159.973 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -31.93 71.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.938 163.606 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.511 ' CD2' ' HB3' ' A' ' 57' ' ' SER . 49.0 m80 -161.51 165.99 15.62 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.305 165.466 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -72.03 -14.25 16.56 Favored 'Cis proline' 0 N--CA 1.482 0.8 0 C-N-CA 122.557 -1.851 . . . . 0.0 113.582 -13.934 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.0 m -59.81 -42.3 93.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.682 -157.11 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 60' ' ' PHE . 11.4 t80 -61.0 -39.25 88.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.53 176.083 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB3' ' CD2' ' A' ' 53' ' ' HIS . 15.9 t -84.54 -12.42 54.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -173.901 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.31 -47.56 19.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.32 175.906 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.553 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 1.6 mpp? -81.71 -41.25 21.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.457 -170.112 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 56' ' ' TYR . 0.8 OUTLIER -61.26 90.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.327 -165.334 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -112.15 -153.2 11.99 Favored Glycine 0 CA--C 1.543 1.843 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 169.829 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -62.61 -12.32 27.72 Favored 'Trans proline' 0 N--CA 1.483 0.904 0 C-N-CA 122.463 2.109 . . . . 0.0 113.554 178.078 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.467 ' HG2' ' N ' ' A' ' 64' ' ' GLY . 2.4 ttmm -61.04 148.4 40.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.414 -168.103 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.467 ' N ' ' HG2' ' A' ' 63' ' ' LYS . . . -148.4 -132.31 2.15 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 169.66 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 10.9 t80 178.79 -80.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.348 169.042 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.93 -153.33 17.4 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.277 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.454 ' HB3' ' NH1' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -61.14 -77.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.366 -169.229 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 167.89 -127.84 1.62 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -169.712 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.49 -158.3 18.21 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 170.547 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -133.12 -166.61 1.79 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.296 -169.763 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.92 -81.15 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.018 -168.791 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.5 p -177.61 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.465 169.113 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -173.44 29.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.414 -169.769 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.7 m -94.26 138.75 31.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.436 -177.167 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 66.8 -76.13 0.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.321 -170.124 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.8 mttp . . . . . 0 C--O 1.24 0.587 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.387 -170.078 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.407 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 141.02 46.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.388 -168.734 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.9 t -82.25 117.02 66.92 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.164 -163.917 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.83 -21.92 72.06 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.727 2.285 . . . . 0.0 113.216 170.049 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? -76.42 -71.1 0.41 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.482 -175.836 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.64 -22.72 16.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.582 -164.991 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.47 55.49 0.15 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.503 -171.38 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.479 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -117.5 -169.25 1.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.948 159.771 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.94 148.43 25.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.65 167.096 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.7 t -109.7 111.09 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.651 -167.053 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 34.7 t80 -74.79 159.03 32.47 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.306 178.01 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.463 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 6.7 m-85 -60.58 -62.38 1.9 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.75 -160.118 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -1.72 11.63 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.72 -173.752 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -102.27 14.06 32.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.379 178.625 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -96.6 151.41 19.63 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.33 -161.496 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.522 HG21 HD22 ' A' ' 28' ' ' LEU . 16.0 m -143.9 145.02 22.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.601 156.19 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.1 m -115.71 136.26 53.23 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.715 -166.965 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 t -178.43 128.69 0.12 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.195 -169.316 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.12 34.97 21.23 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.605 -172.479 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.46 18.13 60.68 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 168.119 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -141.4 155.3 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 165.284 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -90.95 176.58 6.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.403 -165.822 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.583 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 26.2 m95 -149.8 -177.88 6.14 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.24 -177.079 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -99.2 145.97 26.66 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.553 168.928 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.1 mtp180 -61.22 -48.65 91.05 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.726 -168.899 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -64.0 -34.8 57.68 Favored 'Trans proline' 0 N--CA 1.483 0.87 0 C-N-CA 122.492 2.128 . . . . 0.0 113.647 177.049 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.01 -45.39 89.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.338 -166.131 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.838 HD21 ' CE1' ' A' ' 42' ' ' HIS . 9.6 tp -60.41 93.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.316 -162.173 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 2.2 mttt -141.02 153.58 45.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.331 -164.268 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -73.35 126.4 30.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.403 173.27 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 19.3 mt-10 -96.09 33.46 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.046 168.509 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -128.05 -52.8 1.31 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.077 175.619 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.21 -18.81 13.21 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.018 -177.462 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.12 36.42 40.63 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.384 -1.086 . . . . 0.0 110.384 175.762 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -100.39 137.0 39.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.476 170.38 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 23.3 m -66.96 147.96 52.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.433 170.315 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.766 HD13 ' CB ' ' A' ' 42' ' ' HIS . 6.9 mt -113.08 154.25 26.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.269 -169.939 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.2 m -154.28 158.24 39.9 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.128 -160.597 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m 60.59 11.96 3.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.122 171.519 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 59.19 54.45 37.81 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.201 -1.159 . . . . 0.0 110.201 -159.406 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.82 6.61 83.5 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 114.634 -0.783 . . . . 0.0 111.959 177.675 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.838 ' CE1' HD21 ' A' ' 28' ' ' LEU . 15.4 p-80 -107.07 -172.18 2.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.38 -166.195 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.88 -163.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.813 163.897 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.8 tt0 -147.86 133.85 19.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.258 176.497 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.402 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 55.0 t-80 -135.14 125.28 26.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 162.936 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.27 -150.19 0.42 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 -152.753 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -96.0 32.46 6.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 166.993 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -117.84 99.16 52.1 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-O 121.702 0.763 . . . . 0.0 109.799 170.724 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.0 Cg_endo -58.81 165.34 8.36 Favored 'Trans proline' 0 N--CA 1.486 1.04 0 C-N-CA 122.161 1.907 . . . . 0.0 113.649 173.302 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.517 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -153.73 -165.46 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.072 171.311 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 72.4 m -57.45 133.21 55.0 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.351 162.543 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -60.7 -31.01 70.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.926 161.469 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.57 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 48.9 m80 -159.4 162.24 25.94 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.115 163.858 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -74.28 -17.42 18.95 Favored 'Cis proline' 0 N--CA 1.482 0.805 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.552 -14.093 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.19 -37.05 76.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.796 -155.311 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -62.49 -60.63 3.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.384 172.079 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.57 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 1.6 m -71.74 -17.19 62.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.414 -166.2 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.98 -51.58 13.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.334 171.651 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.6 ttt -81.79 -43.32 18.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.382 -169.577 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.402 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 9.8 m-85 -118.09 113.83 22.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.35 171.033 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -61.0 141.48 48.26 Favored Glycine 0 CA--C 1.542 1.774 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 -168.408 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.418 ' HG3' ' OG ' ' A' ' 57' ' ' SER . 2.8 Cg_exo -62.43 98.72 0.19 Allowed 'Trans proline' 0 N--CA 1.484 0.965 0 C-N-CA 122.605 2.203 . . . . 0.0 113.494 -173.651 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -117.31 -17.69 10.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.553 170.158 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.34 -170.77 33.06 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 170.37 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 65' ' ' PHE . 1.5 p90 -137.6 -173.95 3.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.33 169.991 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.55 159.76 8.69 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 -170.143 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 0.3 OUTLIER 64.48 80.45 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.347 -0.426 . . . . 0.0 110.494 -169.985 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -86.1 104.35 2.87 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 177.75 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.81 -163.71 35.73 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -170.124 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.69 93.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.368 -0.416 . . . . 0.0 110.236 169.919 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.81 -13.52 24.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.092 168.448 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.41 38.19 5.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.373 178.202 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m170 -61.38 98.58 0.09 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.447 177.932 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.41 24.62 12.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.401 170.304 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -94.82 149.41 21.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.356 169.933 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.503 ' HD2' ' H ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.415 -170.068 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.486 1.064 0 N-CA-C 113.554 0.559 . . . . 0.0 113.554 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.515 ' HG2' ' NZ ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -144.36 144.31 31.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.375 169.635 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -87.79 118.89 70.28 Favored Pre-proline 0 C--O 1.251 1.136 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.135 -164.56 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -60.97 -27.15 84.35 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.712 2.275 . . . . 0.0 113.211 169.108 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -69.78 0.36 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.459 -173.986 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -96.59 -22.07 17.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.621 -166.922 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.05 53.73 0.19 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.45 -171.238 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 -167.91 1.25 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.001 160.674 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.48 149.09 26.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.269 162.803 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 52.0 t -109.62 111.15 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.667 -166.502 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.485 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.6 t80 -78.84 161.76 26.54 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.282 178.117 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.68 -62.64 1.73 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.966 -157.723 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -10.83 60.16 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.779 -173.681 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.8 pt-20 -103.04 43.09 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.189 171.15 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -111.84 147.31 36.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.548 -177.45 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -140.43 143.15 29.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.459 154.188 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.9 m -115.61 133.82 55.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.616 -166.617 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.475 ' OG ' HD22 ' A' ' 19' ' ' LEU . 17.1 t -178.3 136.68 0.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.333 -171.4 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.97 29.43 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.65 -172.992 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.23 17.33 70.06 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 167.824 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' NZ ' ' HG2' ' A' ' 2' ' ' LYS . 1.2 tttm -143.64 160.13 41.22 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 164.256 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.02 177.34 6.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.306 -165.686 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 27.6 m95 -151.94 -174.94 5.03 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.116 -178.84 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.8 m80 -101.4 146.99 26.87 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.543 169.546 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 51.1 ttp180 -60.98 -47.14 96.35 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.727 -168.75 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -63.43 -35.36 61.47 Favored 'Trans proline' 0 N--CA 1.484 0.936 0 C-N-CA 122.55 2.166 . . . . 0.0 113.576 175.483 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -67.1 -50.81 60.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.328 -163.236 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.429 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.3 tp -60.37 89.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.339 -163.674 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.3 ttmm -147.57 141.96 26.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.321 -164.95 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.5 t -60.83 119.71 8.73 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.283 165.627 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -96.91 27.2 4.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.962 168.02 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.73 -55.71 2.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.092 169.165 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.3 p -106.96 -24.52 11.98 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.652 -174.351 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.79 45.3 7.3 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -177.436 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.24 124.87 46.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.304 168.137 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 m -61.0 139.48 58.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.269 168.109 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 75.0 mt -103.39 127.03 50.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.273 -165.371 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -69.57 -170.21 0.28 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.565 169.603 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -105.14 18.15 22.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.6 -168.474 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.696 ' H ' HG23 ' A' ' 38' ' ' THR . . . -178.62 58.71 0.09 OUTLIER Glycine 0 CA--C 1.531 1.048 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 162.334 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.25 10.98 1.56 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.88 168.446 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 14.6 p80 -113.4 -169.09 1.43 Allowed 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.415 -0.392 . . . . 0.0 110.868 -175.913 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -154.08 -164.17 1.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.909 168.201 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.3 pp20? -164.08 139.52 6.11 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.085 170.638 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CG ' ' CE1' ' A' ' 60' ' ' PHE . 57.0 t60 -95.3 161.99 13.86 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.3 159.951 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 28.6 mm-40 -61.44 88.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.049 -166.364 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.18 -66.0 0.35 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.304 -1.119 . . . . 0.0 110.304 -167.059 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.14 141.91 19.09 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.422 0.63 . . . . 0.0 109.82 -163.445 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.54 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.7 Cg_endo -68.44 160.05 50.82 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.967 2.445 . . . . 0.0 113.734 169.552 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 60.8 m-85 -147.63 -163.35 1.75 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.568 164.426 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.2 m -56.94 138.36 54.13 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.265 159.078 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -60.73 -35.84 77.37 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.988 164.113 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.677 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 64.8 m80 -157.85 165.14 19.3 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.227 164.423 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -73.07 -15.36 18.1 Favored 'Cis proline' 0 C--N 1.354 0.868 0 C-N-CA 122.512 -1.87 . . . . 0.0 113.595 -14.192 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.8 m -59.61 -39.42 84.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.619 -156.636 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -61.15 -56.99 14.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.351 171.919 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.677 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -65.66 -26.52 67.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.399 -169.418 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.43 -42.32 11.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.321 -169.896 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -50.6 12.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.32 -175.302 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CG ' ' A' ' 45' ' ' HIS . 15.9 m-85 -94.01 90.36 6.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.388 -167.531 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -132.78 -99.27 0.71 Allowed Glycine 0 CA--C 1.545 1.922 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 170.366 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -57.78 172.13 1.25 Allowed 'Trans proline' 0 N--CA 1.488 1.147 0 C-N-CA 122.4 2.067 . . . . 0.0 113.368 167.075 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.1 tptt 179.89 -77.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.352 169.539 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.78 122.31 4.63 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 -168.17 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.3 t80 71.68 146.51 0.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.287 172.246 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 171.92 -72.33 0.1 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 170.383 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -143.44 141.67 30.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.377 -0.412 . . . . 0.0 110.355 169.96 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -157.47 153.47 24.69 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -178.386 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.37 165.54 13.73 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -178.329 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -122.5 29.76 6.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.256 169.885 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.55 165.64 12.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.1 168.841 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.8 t -106.9 -63.18 1.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.384 -169.197 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -159.28 -59.7 0.07 Allowed 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.414 177.851 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.5 p -64.95 156.11 32.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.494 169.998 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -118.4 20.24 13.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.36 -169.977 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.368 170.067 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.443 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 12.1 Cg_endo . . . . . 0 N--CA 1.486 1.044 0 N-CA-C 113.617 0.583 . . . . 0.0 113.617 . . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.442 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -143.9 152.83 41.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.461 -167.063 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -89.99 118.01 68.55 Favored Pre-proline 0 C--O 1.249 1.043 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.177 -165.657 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -57.89 -26.82 76.05 Favored 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.61 2.207 . . . . 0.0 113.175 168.933 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -74.45 -73.41 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.417 -174.885 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -93.87 -21.8 19.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 -165.683 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 t0 72.59 58.63 0.13 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.526 -172.601 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' NZ ' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -119.74 -168.96 1.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.027 159.452 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 3.7 mt-10 -102.71 154.03 19.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.696 162.851 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 37.1 t -113.5 114.06 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.452 -162.85 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.62 154.79 41.51 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.365 177.125 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.65 -62.24 2.0 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.847 -159.934 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.44 -1.22 10.12 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.648 -173.399 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -102.57 14.09 32.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.466 178.315 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 153.27 17.97 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 -160.815 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.804 HG21 HD22 ' A' ' 28' ' ' LEU . 15.1 m -145.11 151.15 15.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.699 155.703 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -115.41 136.23 53.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.724 -168.726 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.635 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 23.1 t -177.84 135.75 0.18 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.279 -177.923 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.3 mm? 60.04 28.41 17.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -169.844 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.27 18.21 64.86 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 170.22 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.558 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -138.05 153.85 49.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 164.893 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -87.87 176.35 7.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.412 -165.973 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.4 m95 -147.52 -177.99 6.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.134 -176.907 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.3 m80 -100.96 141.36 33.96 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.965 -1.471 . . . . 0.0 110.526 167.691 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.35 84.97 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.827 -168.251 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.562 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -58.5 -35.65 98.4 Favored 'Trans proline' 0 N--CA 1.483 0.905 0 C-N-CA 122.608 2.205 . . . . 0.0 113.538 174.78 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.91 -43.5 98.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.114 -168.832 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.912 HD11 ' CE1' ' A' ' 42' ' ' HIS . 11.9 tp -63.29 86.62 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.455 -160.442 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -131.51 148.74 52.66 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.247 -167.982 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -75.22 129.41 37.42 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.345 172.322 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -98.05 41.87 1.11 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.163 166.581 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.718 ' HD3' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -143.55 -40.79 0.3 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.466 -176.949 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.06 -12.61 9.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.332 173.579 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.9 42.45 99.65 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -124.24 136.89 54.49 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 164.332 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 29' ' ' LYS . 2.7 t -61.37 -170.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.242 -169.142 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.655 HD13 ' CB ' ' A' ' 42' ' ' HIS . 12.0 mt -143.1 150.96 40.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.478 -163.671 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -83.05 -171.99 3.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.294 -164.019 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 38' ' ' THR . 97.6 p -64.39 77.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.323 166.12 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 53.96 9.42 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 178.642 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.59 12.93 10.96 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.469 -0.653 . . . . 0.0 111.469 165.791 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.912 ' CE1' HD11 ' A' ' 28' ' ' LEU . 24.7 p-80 -102.56 -168.79 1.57 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.579 -0.81 . . . . 0.0 110.528 175.933 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.18 158.62 14.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.889 161.304 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.459 ' HB2' ' HH2' ' A' ' 23' ' ' TRP . 2.2 tm-20 -113.13 127.3 56.16 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.982 -163.2 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.533 ' NE2' ' HG3' ' A' ' 46' ' ' GLU . 86.3 t60 -121.48 130.24 53.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.675 160.279 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.533 ' HG3' ' NE2' ' A' ' 45' ' ' HIS . 3.2 mm-40 58.27 34.73 24.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.074 171.698 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 36.65 70.65 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 171.642 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.06 128.2 9.18 Favored Pre-proline 0 C--O 1.242 0.667 0 CA-C-O 121.655 0.741 . . . . 0.0 109.612 162.358 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HB3' ' CD2' ' A' ' 42' ' ' HIS . 14.6 Cg_endo -63.59 159.9 38.65 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 C-N-CA 122.567 2.178 . . . . 0.0 113.57 174.45 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 72.9 m-85 -151.47 -174.11 4.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.758 165.761 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.8 m -57.63 123.56 16.04 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 113.569 -1.65 . . . . 0.0 110.229 164.362 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -60.73 -28.65 68.84 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.11 -1.404 . . . . 0.0 109.931 165.095 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.456 ' CD2' ' CB ' ' A' ' 57' ' ' SER . 56.7 m80 -155.89 160.27 30.93 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.862 -1.063 . . . . 0.0 108.982 159.255 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -74.57 -20.24 16.26 Favored 'Cis proline' 0 C--N 1.354 0.839 0 C-N-CA 122.803 -1.749 . . . . 0.0 113.699 -11.994 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.599 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 81.9 m -58.91 -56.1 26.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.808 -155.449 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.48 ' CE1' ' CD2' ' A' ' 60' ' ' PHE . 7.0 t80 -61.06 -45.33 95.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.293 -179.772 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.456 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 17.2 t -61.02 -15.4 31.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.547 175.407 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . -85.92 -54.67 4.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.184 -173.21 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.718 ' HE3' ' HD3' ' A' ' 32' ' ' LYS . 2.3 mtm -100.09 -35.3 9.73 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.248 -172.204 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.491 ' CE1' ' CG ' ' A' ' 45' ' ' HIS . 54.3 m-85 -107.36 -169.72 1.58 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.173 165.337 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -129.0 -152.23 7.62 Favored Glycine 0 CA--C 1.542 1.771 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 -174.534 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -56.14 -87.29 0.01 OUTLIER 'Trans proline' 0 N--CA 1.487 1.117 0 C-N-CA 122.371 2.048 . . . . 0.0 113.469 -171.104 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.502 ' HD2' ' CE2' ' A' ' 65' ' ' PHE . 1.5 mmmt -111.82 -78.56 0.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.427 176.988 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.41 -102.0 0.33 Allowed Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 166.973 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.502 ' CE2' ' HD2' ' A' ' 63' ' ' LYS . 2.0 m-85 60.62 76.01 0.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.184 -0.508 . . . . 0.0 110.595 -172.435 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 61.77 78.81 0.15 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 170.283 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.96 33.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.269 -0.466 . . . . 0.0 110.423 170.251 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.27 97.1 1.72 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 169.411 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.0 145.18 7.75 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 -170.661 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.49 -162.98 0.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.369 -176.115 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.43 75.65 0.38 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.722 -168.529 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.89 -28.63 9.98 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.462 -177.765 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 71.99 -60.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.415 170.775 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.0 m 69.99 88.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.416 169.693 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -93.91 -78.29 0.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.277 168.815 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.319 169.234 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.429 0.511 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.49 133.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.439 169.24 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.7 t -89.58 133.04 35.21 Favored Pre-proline 0 C--O 1.243 0.753 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.166 -165.36 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 6.3 Cg_exo -73.06 -26.78 14.67 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.246 2.631 . . . . 0.0 113.44 171.533 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 -64.41 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.297 -164.712 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -92.5 -28.9 16.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.371 -164.792 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 73.72 58.79 0.09 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.525 -165.832 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.83 -168.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.838 158.245 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -108.82 149.57 28.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.624 160.772 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.935 HG22 ' CD2' ' A' ' 24' ' ' HIS . 65.5 t -103.5 117.89 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.595 -167.662 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -91.88 55.12 2.59 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.951 -156.072 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 61.59 -79.09 0.02 OUTLIER 'General case' 0 C--N 1.34 0.155 0 CA-C-N 113.976 -1.466 . . . . 0.0 110.358 178.477 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.18 -2.12 36.11 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.512 -163.068 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.69 13.96 30.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.251 176.682 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -83.78 153.48 24.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.258 -164.974 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.601 ' CG2' HD22 ' A' ' 28' ' ' LEU . 17.2 m -148.26 122.18 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.741 157.362 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 88.4 m -98.59 135.81 39.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.408 -162.197 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.455 ' OG ' HD22 ' A' ' 19' ' ' LEU . 21.8 t -178.0 137.39 0.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.586 -167.594 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.23 25.92 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.548 -173.039 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.58 -24.2 24.42 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 165.868 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -127.33 139.72 52.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 114.703 -0.749 . . . . 0.0 110.029 -177.251 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -68.86 -179.17 1.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.338 -161.394 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 60.3 m95 -145.77 -177.6 5.67 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 113.59 -1.641 . . . . 0.0 109.396 178.659 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.935 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -100.49 143.73 30.32 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.616 168.83 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 21.7 ttp85 -63.57 -53.22 53.28 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.81 179.13 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.7 Cg_endo -53.25 -13.41 3.22 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 122.459 2.106 . . . . 0.0 113.612 172.296 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -96.38 -64.26 1.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.328 -179.171 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.648 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.8 OUTLIER -64.85 91.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.398 -166.418 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.85 170.68 17.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.234 168.638 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.5 t -60.79 150.62 32.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.326 168.373 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.9 mm-40 -118.74 25.7 10.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.732 160.063 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.47 -59.99 1.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.172 167.902 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -102.3 -48.44 4.19 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.645 -167.759 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.42 56.45 0.51 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 167.284 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -131.01 137.52 49.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.39 167.386 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.4 m -60.73 153.16 24.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.442 174.02 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.5 mt -113.54 153.38 28.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.404 -165.424 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.477 HG22 ' N ' ' A' ' 39' ' ' SER . 93.8 m -68.72 166.58 17.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.475 -178.025 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.477 ' N ' HG22 ' A' ' 38' ' ' THR . 66.4 m -62.4 77.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.415 170.175 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.3 55.2 3.53 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 172.291 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.36 11.53 4.98 Favored Glycine 0 CA--C 1.522 0.519 0 CA-C-N 115.102 -0.549 . . . . 0.0 111.777 166.172 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.648 ' CE1' HD11 ' A' ' 28' ' ' LEU . 3.9 p80 -99.45 -169.26 1.73 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.84 -0.68 . . . . 0.0 110.47 177.49 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -130.91 171.65 12.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.339 168.91 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -147.76 138.35 23.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.05 -170.879 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -121.61 114.79 21.67 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.437 -0.801 . . . . 0.0 108.858 164.797 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.73 -148.11 0.44 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.522 -152.408 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.45 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.35 35.0 4.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 166.923 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm -107.37 87.55 3.36 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 121.211 0.529 . . . . 0.0 109.756 169.229 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.0 Cg_endo -62.85 147.9 94.09 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 122.526 2.151 . . . . 0.0 113.552 -174.847 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.5 m-85 -144.95 -165.78 2.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.922 162.095 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 99.5 m -59.11 -178.01 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.703 171.534 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.84 -32.89 11.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.178 164.586 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.52 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.2 m-70 -164.75 165.97 11.75 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.03 -0.987 . . . . 0.0 109.541 171.472 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.52 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 Cg_endo -69.61 -6.48 9.21 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.635 -1.819 . . . . 0.0 113.604 -11.515 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.5 m -60.28 -51.05 71.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.425 -162.001 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -60.73 -37.42 81.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.416 -168.136 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 60.1 p -86.91 -21.66 26.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.515 -173.817 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.358 -170.232 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.3 ttt -105.21 -34.54 7.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.312 -171.621 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -96.33 29.5 2.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.405 -169.615 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.45 179.8 30.78 Favored Glycine 0 CA--C 1.542 1.733 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 176.245 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -58.2 -80.68 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.997 0 C-N-CA 122.55 2.167 . . . . 0.0 113.581 -173.543 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 171.9 1.14 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.358 -169.569 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -130.77 -136.52 3.97 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 170.494 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -143.56 175.15 10.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.369 -0.415 . . . . 0.0 110.398 170.16 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -81.9 108.48 2.91 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 178.257 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.2 mmm-85 64.74 -171.67 0.18 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.404 178.148 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 166.83 166.5 26.03 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 170.283 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.09 111.49 0.32 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 170.344 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -140.87 -45.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.451 -0.374 . . . . 0.0 110.192 -169.868 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.41 -171.07 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.042 -168.96 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.444 ' HG ' ' HE1' ' A' ' 75' ' ' PHE . 1.5 m 65.7 113.55 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.334 169.185 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.6 158.15 43.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.41 169.792 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.8 m 69.65 -80.62 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.427 -178.273 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.444 ' HE1' ' HG ' ' A' ' 72' ' ' SER . 0.2 OUTLIER 65.03 158.81 0.1 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.33 169.671 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.552 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.401 178.078 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.242 0 N-CA-C 113.369 0.488 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 2.1 ttmm 63.77 162.34 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.218 165.331 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.8 t -80.6 131.27 61.6 Favored Pre-proline 0 C--O 1.243 0.737 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.486 -163.256 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.605 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.2 Cg_exo -70.4 -9.11 25.17 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 123.223 2.616 . . . . 0.0 113.504 170.328 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -102.19 -72.55 0.68 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.332 -172.38 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -91.99 -21.85 20.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.524 -160.157 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 t0 73.63 61.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.507 -167.164 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.92 166.65 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.076 159.447 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.532 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -85.4 148.72 25.87 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.42 171.92 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -110.16 116.85 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.742 -160.341 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -168.39 1.17 Allowed 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -74.28 -84.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.509 -165.973 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.78 -10.39 58.2 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.193 -0.603 . . . . 0.0 111.713 -159.158 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -104.98 42.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.963 169.621 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.35 149.12 25.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.396 176.324 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.838 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -148.85 144.71 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.065 162.05 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 m -114.99 135.85 53.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.378 -168.822 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.424 ' HB2' ' HE1' ' A' ' 42' ' ' HIS . 6.8 t -177.79 128.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.366 -168.859 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 60.17 22.11 11.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.423 -170.77 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.4 -24.4 27.6 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 164.524 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.4 137.37 51.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 114.76 -0.72 . . . . 0.0 110.24 -177.192 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.67 178.51 5.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.32 -163.388 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.605 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 41.6 m95 -146.46 177.4 9.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.59 -177.311 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -98.21 137.55 36.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.463 169.501 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 10.1 ttp85 -60.8 -47.28 96.22 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.878 -170.702 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.6 Cg_exo -54.75 -35.77 88.71 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.576 2.184 . . . . 0.0 113.544 170.929 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.34 -54.2 13.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.317 -172.967 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HG21 ' A' ' 16' ' ' VAL . 2.1 tp -62.67 96.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.322 -166.243 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -139.82 177.88 7.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 166.863 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.4 t -61.37 170.33 1.83 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.114 164.553 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.576 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 1.8 pt-20 -140.45 20.85 2.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.652 160.08 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.488 ' HE2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -100.2 -57.65 2.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.271 167.577 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.62 -49.83 4.96 Favored 'General case' 0 CA--C 1.524 -0.05 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.525 -170.895 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.05 59.73 0.61 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 169.931 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.68 139.17 27.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.058 0.456 . . . . 0.0 110.457 166.857 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.585 HG22 ' H ' ' A' ' 37' ' ' LEU . 1.8 m -61.49 171.62 1.42 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.437 -173.571 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.703 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.8 mt -129.05 -177.82 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.366 -170.858 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -109.31 -169.44 1.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.548 -170.154 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.5 t -61.32 -25.26 67.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.342 -170.059 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.513 ' H ' HG23 ' A' ' 38' ' ' THR . . . 173.37 70.52 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.79 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.57 10.7 8.53 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.615 -0.594 . . . . 0.0 111.615 166.134 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.703 ' CB ' HD13 ' A' ' 37' ' ' LEU . 22.0 p-80 -90.63 -169.5 2.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.441 173.361 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.7 172.59 12.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.328 167.632 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.543 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -128.57 147.76 50.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.964 166.758 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.495 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 58.1 t-80 -84.27 -79.37 0.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.837 170.112 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -171.12 73.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.928 167.738 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 155.88 -45.75 0.52 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.545 -174.652 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 2.4 mptp? -143.98 138.61 15.2 Favored Pre-proline 0 C--O 1.242 0.665 0 CA-C-O 121.489 0.661 . . . . 0.0 109.87 -170.927 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.59 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 19.7 Cg_endo -64.18 147.15 91.33 Favored 'Trans proline' 0 N--CA 1.486 1.046 0 C-N-CA 122.658 2.238 . . . . 0.0 113.58 171.012 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.576 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 11.7 m-85 -139.49 -168.12 2.4 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.868 163.814 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 57.3 m -58.42 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.548 166.959 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -102.91 -30.26 10.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.132 161.876 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.509 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m80 -168.46 165.48 7.46 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.412 171.646 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.509 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -70.13 -5.76 9.63 Favored 'Cis proline' 0 N--CA 1.482 0.816 0 C-N-CA 122.576 -1.843 . . . . 0.0 113.741 -10.825 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.6 m -60.07 -41.33 92.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.554 -161.467 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.31 -39.59 94.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.381 -169.335 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.2 m -98.65 -19.34 17.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.328 -168.046 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.22 -53.24 10.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.274 -167.811 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -86.49 -42.18 13.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.37 -168.339 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.495 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 1.3 m-85 -62.83 88.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.325 -167.542 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.478 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 151.7 61.13 0.01 OUTLIER Glycine 0 CA--C 1.544 1.903 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -171.227 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.584 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 5.5 Cg_endo -59.3 -88.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.487 1.117 0 C-N-CA 122.449 2.099 . . . . 0.0 113.51 -169.169 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -147.44 -175.21 4.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.344 -168.133 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -143.23 -110.02 0.73 Allowed Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 169.409 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 66.95 -80.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.366 169.509 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.01 125.41 32.32 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -169.932 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.509 ' H ' ' HD2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -118.07 -170.17 1.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.383 . . . . 0.0 110.363 170.193 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.9 -68.57 1.61 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 170.231 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 74.29 -91.02 0.72 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -170.137 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.48 -77.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.421 -177.087 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.0 mp0 58.95 -84.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.629 -167.351 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 61.54 95.43 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.463 -168.818 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.03 -171.4 3.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.431 177.194 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 t -130.36 -161.32 1.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.399 -170.044 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.32 126.66 28.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.391 -169.979 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.24 0.601 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.439 170.176 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.525 ' H3 ' ' CG ' ' A' ' 22' ' ' ASP . 2.2 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 113.574 0.567 . . . . 0.0 113.574 . . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 8.4 mmtt -138.87 139.86 38.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.467 -170.38 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.1 t -97.76 122.5 54.79 Favored Pre-proline 0 C--O 1.243 0.711 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.202 -165.329 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 8.3 Cg_endo -61.78 -27.64 80.92 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 122.538 2.159 . . . . 0.0 113.024 172.1 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.521 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.75 -55.43 3.57 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.666 -155.977 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -92.03 -27.61 17.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.395 -177.488 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.95 68.29 0.1 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.504 -165.484 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 -167.69 1.86 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.017 160.394 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.425 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -110.34 149.54 30.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.114 162.419 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.5 t -108.68 130.52 61.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.813 -161.553 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.419 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.8 t80 -90.67 178.43 6.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.359 -178.832 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -64.11 -83.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.281 -167.0 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.8 -1.95 10.74 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.554 -161.872 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -102.77 18.32 21.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.21 178.843 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -98.09 146.51 25.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.276 -165.358 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 28' ' ' LEU . 14.5 m -143.3 120.92 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.891 156.515 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 33.3 m -90.31 132.29 35.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.383 -178.559 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -167.94 124.32 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.155 -162.004 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.666 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.28 24.84 14.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.574 -173.528 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 99.13 -25.43 28.25 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 161.221 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -121.77 138.54 54.33 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.848 -0.676 . . . . 0.0 109.976 178.569 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.525 ' CG ' ' H3 ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -73.06 178.6 4.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.37 -160.489 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 63.3 m95 -143.52 177.5 8.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.802 -176.377 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -102.43 139.48 37.97 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.307 168.056 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.563 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 ttt180 -61.04 -51.27 80.3 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.779 -168.242 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 10.3 Cg_endo -56.82 -28.97 79.31 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.489 2.126 . . . . 0.0 113.518 173.036 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -67.31 -64.64 0.81 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.311 177.511 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -64.57 94.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 -163.444 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.19 173.28 9.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.227 167.516 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -60.63 -178.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.187 166.259 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.531 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -135.01 18.8 3.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.736 160.45 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.6 -45.39 1.48 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.536 -168.096 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -107.12 -32.13 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.75 176.057 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.458 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 85.85 64.39 1.49 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 177.382 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.1 tttp -150.15 145.83 26.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.038 -0.581 . . . . 0.0 110.422 -178.537 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.73 153.31 43.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.461 -174.707 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.494 ' HB2' HD23 ' A' ' 28' ' ' LEU . 14.4 mt -122.06 141.12 51.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.339 -168.179 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.528 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -60.88 -175.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.442 -169.348 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 38' ' ' THR . 11.8 p -67.61 72.55 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.407 169.557 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 18' ' ' SER . . . 72.25 57.72 5.49 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 172.13 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -125.53 12.15 7.47 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 164.315 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.788 ' NE2' HD21 ' A' ' 28' ' ' LEU . 2.8 p80 -102.0 -170.31 1.8 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 114.606 -0.797 . . . . 0.0 110.411 176.104 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.81 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -126.9 -174.35 3.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.34 169.902 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.7 tm-20 -164.94 146.26 7.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.971 -168.664 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 -113.73 -51.34 2.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.755 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -171.15 99.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.101 165.9 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.25 12.66 32.35 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.649 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG2' ' HG3' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -141.8 86.99 10.27 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 114.914 -0.643 . . . . 0.0 109.785 -175.632 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.494 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.1 Cg_endo -60.94 147.26 96.13 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.518 2.145 . . . . 0.0 113.608 -176.198 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 4.3 m-85 -135.51 -178.55 5.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.015 164.464 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.9 m -59.31 -178.42 0.06 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.652 172.331 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.81 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 1.1 m-20 -97.37 -34.88 10.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.999 164.481 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 33.1 m80 -154.73 173.94 4.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-O 122.135 0.969 . . . . 0.0 109.344 165.969 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.6 Cg_endo -62.29 -12.93 3.62 Favored 'Cis proline' 0 N--CA 1.498 1.743 0 C-N-CA 121.312 -2.37 . . . . 0.0 112.505 -20.699 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.4 m -58.15 -48.3 80.69 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.85 -158.628 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.76 -41.02 94.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.457 -168.81 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -77.76 -18.92 55.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.55 -176.911 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.24 47.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.215 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.9 ttp -116.14 -30.84 5.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.37 -169.245 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -113.73 94.92 5.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.414 -169.938 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.405 ' HA3' ' HD3' ' A' ' 62' ' ' PRO . . . -74.39 -104.54 0.09 OUTLIER Glycine 0 CA--C 1.543 1.811 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 174.48 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.405 ' HD3' ' HA3' ' A' ' 61' ' ' GLY . 2.7 Cg_exo -62.1 -86.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 122.566 2.178 . . . . 0.0 113.523 -173.733 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.11 176.98 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.325 -171.459 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.39 170.05 5.68 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.547 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 71.85 110.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.379 169.758 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.15 -19.96 15.24 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 169.717 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -174.99 109.42 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.34 -0.43 . . . . 0.0 110.381 169.988 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -157.16 136.14 4.76 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 -178.278 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.67 84.02 0.07 OUTLIER Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 170.268 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -137.74 14.85 2.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.397 -0.402 . . . . 0.0 110.304 170.249 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 58.48 179.66 0.07 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.681 -168.461 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.4 140.96 28.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.419 -169.301 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -149.03 158.52 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.318 169.947 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -63.66 -28.76 70.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.385 -170.182 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.18 25.06 11.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.315 -169.977 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.521 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.376 170.086 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.083 0 N-CA-C 113.418 0.507 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -148.23 165.51 30.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.388 -168.363 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.7 t -78.93 135.83 58.68 Favored Pre-proline 0 C--O 1.244 0.803 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.434 -162.489 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.6 Cg_exo -69.85 -26.39 27.19 Favored 'Trans proline' 0 N--CA 1.484 0.966 0 C-N-CA 123.437 2.758 . . . . 0.0 113.358 166.826 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.401 ' HE3' ' NZ ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -85.97 -65.85 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.365 -167.296 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -97.4 -25.84 15.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.577 -163.965 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.7 t70 72.77 69.7 0.13 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.504 -164.544 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 0.2 OUTLIER -129.6 -168.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.158 163.22 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.69 148.37 28.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.406 160.851 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.4 t -107.71 112.45 40.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.902 -165.919 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CZ ' ' A' ' 12' ' ' PHE . 17.7 t80 -66.95 160.91 25.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.354 176.342 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CZ ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -62.24 -76.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.221 -167.868 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.76 -0.31 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.45 -162.553 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -105.7 16.59 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.279 177.064 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.56 157.8 16.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.263 -166.148 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.549 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.89 123.09 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.82 160.393 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 84.9 m -100.62 135.28 42.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.443 -167.259 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.459 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 6.9 t -177.91 130.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.438 -166.061 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.4 mm? 60.04 37.69 21.03 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.663 -175.158 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.22 17.61 46.38 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 165.709 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -151.33 123.15 8.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.039 168.019 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 6.7 m-20 -63.56 -179.34 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.351 -162.703 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 50.4 m95 -145.79 169.68 18.04 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.708 -178.077 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -92.85 144.02 25.69 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.52 170.245 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.542 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 ttp85 -61.16 -49.51 88.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 -169.833 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 2.9 Cg_exo -57.8 -33.68 97.23 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.692 2.261 . . . . 0.0 113.504 172.728 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.17 -55.81 8.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.28 -171.194 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.688 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.9 tp -60.7 87.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.345 -167.054 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.401 ' NZ ' ' HE3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -129.08 153.39 47.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.224 -170.874 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -65.6 171.38 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.441 164.688 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.537 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 38.6 tt0 -121.54 -21.64 6.16 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.707 173.322 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -94.7 -39.42 10.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.501 -167.53 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.9 p -105.98 -42.49 5.1 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.0 174.701 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.462 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 86.41 58.04 2.01 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 175.601 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.28 139.2 49.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.364 167.792 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 158.27 18.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.32 -176.645 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.6 mt -119.96 137.04 54.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.434 -166.235 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 39' ' ' SER . 39.4 m -67.61 169.76 8.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.523 -178.571 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG22 ' A' ' 38' ' ' THR . 2.3 m -69.55 76.67 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.436 -175.27 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.28 56.64 1.44 Allowed Glycine 0 CA--C 1.529 0.918 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 169.633 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.8 10.72 3.68 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-N 114.908 -0.646 . . . . 0.0 111.824 166.972 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.688 ' CE1' HD11 ' A' ' 28' ' ' LEU . 2.8 p80 -103.54 -170.45 1.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.328 -177.102 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -132.51 -171.72 2.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.061 165.19 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -170.98 154.49 4.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.972 -172.624 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 14.4 p80 -105.86 -169.3 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.067 160.006 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -62.53 81.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.272 -177.424 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 124.18 -33.8 3.73 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 168.651 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.9 OUTLIER -124.51 109.1 28.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-O 121.574 0.702 . . . . 0.0 109.735 -165.199 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.5 Cg_endo -63.7 148.41 92.16 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.651 2.234 . . . . 0.0 113.642 173.122 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 5.1 m-85 -135.44 -168.03 2.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.815 165.684 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 52.8 m -58.45 -169.45 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.974 -1.467 . . . . 0.0 110.489 164.184 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.697 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 0.7 OUTLIER -100.77 -37.67 8.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.23 163.046 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 35.4 m-70 -157.79 172.8 5.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-O 122.195 0.998 . . . . 0.0 109.456 167.154 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 27.0 Cg_endo -63.59 -11.53 4.19 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.486 -2.297 . . . . 0.0 112.516 -19.081 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 58.6 m -58.27 -40.57 82.22 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.71 -158.615 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -61.12 -30.99 70.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.276 -172.714 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.3 t -108.26 24.16 13.43 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.488 176.468 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -102.7 -64.65 1.05 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.246 -175.28 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.426 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 3.8 ttt -85.13 -19.64 31.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.414 -166.15 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.99 94.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.448 -167.109 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.468 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -169.06 49.68 0.22 Allowed Glycine 0 CA--C 1.543 1.805 0 N-CA-C 109.811 -1.316 . . . . 0.0 109.811 171.884 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 9.7 Cg_endo -61.76 -87.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.567 2.178 . . . . 0.0 113.593 -171.961 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.46 87.4 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.343 -167.999 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 174.16 113.56 0.32 Allowed Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -170.207 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.2 t80 176.2 158.87 0.28 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.399 -0.401 . . . . 0.0 110.335 169.733 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.91 152.51 39.6 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 170.296 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -109.6 32.91 4.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.302 -169.787 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -69.99 -27.24 73.3 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 -179.207 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 126.49 -162.0 20.72 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.471 -1.051 . . . . 0.0 110.471 170.339 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -168.96 94.12 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.417 -0.391 . . . . 0.0 110.252 169.854 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -151.34 88.61 1.45 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.061 168.753 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p 61.32 170.48 0.11 Allowed 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.489 -177.966 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 178.44 168.27 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.415 178.662 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 74' ' ' THR . 8.8 t 178.5 91.43 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.384 170.154 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 178.47 85.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.415 170.088 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.392 -170.023 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.636 0.591 . . . . 0.0 113.636 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.94 168.31 20.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.413 177.941 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 12.6 t -77.53 130.93 72.59 Favored Pre-proline 0 C--O 1.246 0.869 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.554 -163.092 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.636 ' HG3' ' HG3' ' A' ' 21' ' ' LYS . 4.1 Cg_exo -68.91 -14.82 39.47 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 C-N-CA 123.23 2.62 . . . . 0.0 113.397 168.679 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.56 ' HE2' ' HD2' ' A' ' 49' ' ' PRO . 8.9 tptp -95.68 -72.36 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.235 -169.545 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -91.74 -23.17 19.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.568 -163.098 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 74.12 55.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 -167.621 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.27 176.91 6.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.699 155.915 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.85 151.26 19.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.783 171.997 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 70.5 t -113.25 111.05 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.852 -163.535 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.33 -167.99 1.04 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.405 -173.779 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -62.56 -83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.203 -164.934 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.58 -15.41 59.25 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.609 -163.233 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -95.87 41.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.98 174.348 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.4 140.88 47.69 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.598 170.781 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 134.32 61.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.838 159.285 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -103.01 139.06 39.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.422 -169.039 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.485 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 3.6 t -177.63 122.55 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.193 -165.965 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.685 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.23 32.6 20.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.506 -171.218 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.42 61.69 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 164.163 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -145.15 125.52 13.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 164.204 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.444 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -66.94 179.81 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.411 -161.028 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.1 m95 -148.34 175.81 10.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 114.205 -1.361 . . . . 0.0 109.724 -176.916 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -95.35 150.26 20.46 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.563 172.24 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.442 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.09 86.12 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.873 -167.594 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -65.51 -36.19 35.28 Favored 'Trans proline' 0 N--CA 1.483 0.89 0 C-N-CA 122.696 2.264 . . . . 0.0 113.526 176.267 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.2 -47.12 87.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.201 -165.174 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.959 HD21 ' NE2' ' A' ' 42' ' ' HIS . 5.0 tp -59.96 92.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.402 -159.774 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.559 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -132.29 165.11 24.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.252 -171.257 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.9 t -61.4 179.39 0.22 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.307 172.333 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.487 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 2.6 tp10 -143.93 22.99 1.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.967 162.605 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.555 ' HE3' ' HB2' ' A' ' 59' ' ' MET . 0.8 OUTLIER -128.79 -37.23 1.76 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.719 -171.426 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.4 p -106.97 -48.3 3.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.483 165.938 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.99 58.32 0.88 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -169.648 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.6 141.39 46.61 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.966 -0.617 . . . . 0.0 110.459 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.559 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -74.66 152.67 39.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.405 -170.455 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.52 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 22.9 mt -117.87 161.13 20.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.336 -168.529 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -103.99 -175.01 2.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.367 -167.511 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 1.5 p -61.04 -18.68 59.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.383 -167.823 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.69 68.32 0.03 OUTLIER Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 169.548 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.08 10.55 5.93 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 167.356 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.959 ' NE2' HD21 ' A' ' 28' ' ' LEU . 3.8 p80 -93.0 -169.74 2.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.415 176.793 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -131.66 -168.79 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.142 168.286 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.519 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -166.67 160.61 15.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.049 168.144 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.46 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 58.2 t-80 -132.44 72.06 1.49 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.96 -177.335 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 58.4 87.17 0.08 Allowed 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.918 -179.603 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.81 -21.27 46.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 165.086 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -132.51 96.38 19.01 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.669 0.747 . . . . 0.0 109.866 -167.991 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.56 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 16.1 Cg_endo -59.49 142.67 99.29 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 122.256 1.97 . . . . 0.0 113.627 175.752 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 73.6 m-85 -135.72 -177.1 4.52 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.017 176.461 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 65.4 m -58.98 -178.21 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.526 168.344 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.78 -27.95 14.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.018 160.976 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 23.1 m80 -169.52 166.53 5.78 Favored Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.497 172.119 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.522 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 Cg_endo -69.16 -6.75 8.6 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.574 -1.844 . . . . 0.0 113.673 -12.071 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HA ' ' HB2' ' A' ' 58' ' ' ALA . 66.4 m -60.52 -49.56 77.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.401 -162.727 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.92 -38.07 84.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.418 -171.455 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.07 32.91 4.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.496 170.208 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.517 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . -78.45 -66.81 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.284 169.742 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.555 ' HB2' ' HE3' ' A' ' 32' ' ' LYS . 2.5 ttm -108.64 -28.53 9.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.411 -169.778 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.53 85.37 3.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.336 -170.016 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 148.15 66.1 0.01 OUTLIER Glycine 0 CA--C 1.544 1.854 0 N-CA-C 109.786 -1.325 . . . . 0.0 109.786 -171.435 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -54.11 101.36 0.07 OUTLIER 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 122.579 2.186 . . . . 0.0 113.534 -172.338 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.55 -36.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.371 -170.318 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.79 -91.78 0.03 OUTLIER Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.172 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.7 124.44 23.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.242 170.174 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.2 97.88 0.67 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 170.142 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.435 ' HG3' ' H ' ' A' ' 68' ' ' GLY . 10.0 ptt85 -103.32 -60.45 1.56 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.333 170.21 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.435 ' H ' ' HG3' ' A' ' 67' ' ' ARG . . . 176.04 127.62 1.05 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 178.694 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -155.22 172.52 33.47 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -178.46 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.11 -60.29 1.9 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.439 -0.381 . . . . 0.0 110.341 169.835 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -123.79 -74.58 0.61 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.049 -168.965 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -126.76 -75.21 0.58 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.388 169.325 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' ' 74' ' ' THR . 27.6 m80 -155.47 -80.38 0.08 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.405 170.039 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.58 HG23 ' O ' ' A' ' 73' ' ' HIS . 4.6 p -164.33 -86.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.446 170.288 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -118.12 -43.0 2.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.326 170.019 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.514 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.415 -178.292 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.479 0.53 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HD2' ' CG ' ' A' ' 9' ' ' GLU . 1.7 mmtp 63.71 156.68 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.343 170.614 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.4 t -80.46 132.33 59.04 Favored Pre-proline 0 C--O 1.244 0.787 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.408 -162.006 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.0 Cg_exo -69.06 -19.78 38.99 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 123.267 2.644 . . . . 0.0 113.312 167.128 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -70.86 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.353 -166.304 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -91.19 -24.07 20.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 -165.142 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 73.45 58.3 0.1 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.534 -167.48 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.5 -168.88 1.56 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.891 158.904 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' CG ' ' HD2' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -109.76 152.09 26.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.574 160.219 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -107.59 110.33 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.746 -163.845 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -74.43 178.23 5.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.151 -179.63 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -61.4 -84.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.567 -165.071 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -6.49 35.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.861 -158.802 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 17.71 11.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.287 -176.858 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.441 ' H ' ' HD2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -85.2 154.29 22.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.246 -163.971 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 28' ' ' LEU . 11.4 m -148.31 121.88 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.254 161.025 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.7 m -102.5 135.4 44.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.389 -163.921 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.496 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 17.7 t -177.99 132.55 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.408 -166.625 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.1 34.68 21.27 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.65 -177.276 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.47 18.17 50.03 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 167.268 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -150.34 125.08 9.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.053 166.703 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.86 -179.77 0.3 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.448 -162.592 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.4 m95 -145.91 -172.14 3.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.066 -1.425 . . . . 0.0 109.446 179.773 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -103.16 148.86 25.24 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.544 169.39 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.566 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 30.4 ttt180 -65.56 -50.36 56.96 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.79 -174.225 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.2 Cg_endo -57.31 -22.81 51.27 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 122.531 2.154 . . . . 0.0 113.542 174.152 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -84.16 -57.91 2.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.299 -170.757 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.805 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -60.79 93.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.456 -166.461 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.5 mtpm? -148.89 150.8 33.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 -174.912 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -66.54 136.08 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.198 161.896 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -115.22 33.41 5.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.044 167.559 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -46.82 3.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.679 167.676 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.3 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.85 179.982 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.52 51.61 3.82 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.456 -1.057 . . . . 0.0 110.456 169.063 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -128.39 128.38 44.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.109 -0.546 . . . . 0.0 110.405 -176.268 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.469 ' HA ' ' CG ' ' A' ' 29' ' ' LYS . 55.8 m -60.98 139.22 58.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.298 168.563 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 13.5 mt -104.8 166.72 10.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.394 -166.359 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.558 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -94.2 -172.01 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.37 -167.935 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.558 ' H ' HG22 ' A' ' 38' ' ' THR . 6.9 p -61.02 -18.35 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.368 -168.141 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.61 0.02 OUTLIER Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 169.05 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.37 10.58 9.9 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 165.938 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.805 ' CE1' HD11 ' A' ' 28' ' ' LEU . 7.3 p80 -94.57 -169.91 2.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.422 177.614 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.566 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -137.61 -164.25 1.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.167 168.634 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -160.18 148.34 16.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.231 174.329 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -128.0 70.32 1.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.884 -166.642 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 58.36 89.64 0.05 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.898 -178.473 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.75 -28.86 12.54 Favored Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 164.847 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -141.98 137.42 15.94 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 121.439 0.637 . . . . 0.0 109.779 -173.553 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.9 Cg_endo -63.57 150.83 87.53 Favored 'Trans proline' 0 N--CA 1.486 1.05 0 C-N-CA 122.649 2.233 . . . . 0.0 113.505 169.067 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 86.1 m-85 -141.05 -164.9 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.949 162.799 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 13.5 m -57.43 -177.52 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.641 167.602 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.566 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -100.38 -26.12 13.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.844 158.351 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.538 ' CD2' ' HB2' ' A' ' 57' ' ' SER . 25.3 m80 -170.82 166.22 4.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 CA-C-N 114.645 -1.162 . . . . 0.0 109.343 172.178 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 8.2 Cg_endo -71.08 -7.84 12.62 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.656 -1.81 . . . . 0.0 113.604 -12.279 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.8 m -60.06 -32.42 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.534 -160.87 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -77.19 -36.08 55.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.334 -172.538 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.538 ' HB2' ' CD2' ' A' ' 53' ' ' HIS . 19.6 m -93.55 24.04 4.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.467 169.813 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.478 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . -81.7 -54.09 5.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.345 179.677 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.444 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 7.2 ttm -108.32 -17.99 13.87 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.71 -173.798 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.444 ' CE1' ' HB3' ' A' ' 59' ' ' MET . 2.0 m-85 -132.23 -169.69 2.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.006 -164.256 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.532 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . 72.69 51.68 11.21 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -175.069 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 8.1 Cg_endo -61.08 71.39 0.08 OUTLIER 'Trans proline' 0 N--CA 1.486 1.069 0 C-N-CA 122.571 2.18 . . . . 0.0 113.508 168.014 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -88.39 -19.05 27.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.402 -167.535 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.29 63.19 4.18 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 -169.391 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 62' ' ' PRO . 8.8 p90 173.52 168.46 0.17 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.272 168.96 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -151.11 -56.33 0.01 OUTLIER Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -170.54 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -113.2 87.63 2.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.437 -0.382 . . . . 0.0 110.378 -170.577 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -166.96 124.84 1.26 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.124 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.37 76.06 0.19 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -96.5 -39.66 9.45 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.117 -0.542 . . . . 0.0 110.239 -176.129 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -63.29 124.94 22.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.05 -168.9 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.14 132.15 20.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.424 169.404 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -86.92 140.65 29.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.365 -169.857 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 75' ' ' PHE . 3.9 t -71.41 -55.27 8.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.468 169.938 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 76' ' ' LYS . 22.7 p90 -165.09 -37.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.4 169.65 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.487 ' N ' ' CD1' ' A' ' 75' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.456 170.051 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.441 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 3.7 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 N-CA-C 113.513 0.543 . . . . 0.0 113.513 . . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.84 143.48 0.74 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.271 -168.541 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.1 t -80.79 131.08 61.5 Favored Pre-proline 0 C--O 1.245 0.85 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.399 -162.361 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 5.3 Cg_exo -68.56 -15.85 41.95 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 123.277 2.651 . . . . 0.0 113.372 168.39 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.37 -71.41 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.384 -167.743 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.6 p -91.53 -23.02 20.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.474 -162.249 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 t0 73.71 57.34 0.1 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.535 -166.444 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 174.68 8.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.971 158.556 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.14 150.5 20.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.701 168.205 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 55.6 t -111.4 113.63 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.829 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 12' ' ' PHE . 60.7 t80 -66.11 170.06 6.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.421 177.278 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.493 ' N ' ' CD2' ' A' ' 11' ' ' TYR . 38.3 m-85 -61.89 -82.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.515 -169.347 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.74 -10.96 60.37 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.758 -162.598 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -103.8 44.49 1.02 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.06 168.848 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -109.7 151.49 26.84 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.444 171.117 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.468 HG21 HD22 ' A' ' 28' ' ' LEU . 17.5 m -136.66 147.54 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.863 160.165 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 m -116.22 135.31 54.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.443 -166.783 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.459 ' C ' HD22 ' A' ' 19' ' ' LEU . 13.7 t -178.17 123.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -171.156 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.26 32.42 20.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.423 -171.029 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.28 18.72 65.52 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 162.883 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.55 128.26 19.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 166.377 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.46 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -69.77 177.75 2.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.367 -164.286 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.7 m95 -146.49 178.22 8.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.614 -176.253 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.7 m80 -98.79 140.22 33.3 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 114.075 -1.421 . . . . 0.0 110.494 169.035 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.588 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.38 -46.67 94.87 Favored Pre-proline 0 CA--C 1.544 0.73 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.848 -172.103 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 11.8 Cg_exo -48.78 -37.26 35.27 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.713 2.275 . . . . 0.0 113.486 167.781 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.45 -58.79 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.359 -165.389 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.808 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.0 tp -60.54 89.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.368 -164.575 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 mtmt -128.99 177.03 7.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.112 168.482 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.9 t -59.82 166.6 2.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.401 169.057 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -131.33 25.51 4.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.766 162.006 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tppm? -114.19 -63.59 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.324 169.147 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -92.05 -42.02 10.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.493 -165.333 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.2 62.5 0.81 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 -171.128 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -132.87 144.9 50.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.469 173.972 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.97 143.68 50.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.497 170.053 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HB3' ' CG ' ' A' ' 42' ' ' HIS . 88.0 mt -109.08 -168.22 1.31 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.437 -169.412 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.8 170.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.249 -167.385 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.01 18.5 11.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.423 -175.716 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.62 50.61 0.06 OUTLIER Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 162.8 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 58.34 54.1 40.41 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 156.515 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.808 ' NE2' HD21 ' A' ' 28' ' ' LEU . 15.7 p80 -60.43 -170.7 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.029 -0.585 . . . . 0.0 110.586 178.25 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB1' ' CE1' ' A' ' 56' ' ' TYR . . . -135.63 175.69 9.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.404 -177.672 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -160.49 141.49 11.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.068 166.117 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.69 ' CD2' ' CD1' ' A' ' 50' ' ' TYR . 21.4 m-70 -88.79 -42.16 12.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.388 -166.695 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.49 47.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.043 -171.31 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 21.59 53.59 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 -177.473 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -141.18 96.04 7.28 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.852 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.2 Cg_endo -62.97 144.49 93.19 Favored 'Trans proline' 0 N--CA 1.485 0.99 0 C-N-CA 122.714 2.276 . . . . 0.0 113.66 -170.217 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.69 ' CD1' ' CD2' ' A' ' 45' ' ' HIS . 1.3 m-85 -126.62 -174.12 3.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 169.969 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 64.3 m -59.2 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.123 -1.398 . . . . 0.0 110.511 169.297 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -110.47 -32.68 6.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.74 158.404 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.551 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.3 m80 -145.23 175.01 2.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.365 162.647 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.7 Cg_endo -59.76 -15.66 2.49 Favored 'Cis proline' 0 N--CA 1.5 1.868 0 C-N-CA 120.651 -2.645 . . . . 0.0 112.331 -25.354 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.8 m -59.14 -50.61 73.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.798 -160.278 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.591 ' CE1' ' HB1' ' A' ' 43' ' ' ALA . 11.0 t80 -69.14 -41.21 77.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.462 -172.139 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.551 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 26.9 t -68.9 -21.35 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.415 179.785 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.48 98.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.29 -171.684 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.6 mmt -86.75 -42.58 13.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.418 169.433 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -95.26 101.92 13.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.36 -168.587 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.96 -104.97 0.19 Allowed Glycine 0 CA--C 1.543 1.828 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 170.471 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -56.05 -155.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.486 1.069 0 C-N-CA 122.473 2.115 . . . . 0.0 113.431 171.322 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.31 86.98 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 168.823 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.24 -142.52 3.54 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 -170.078 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 65.46 -77.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.366 -169.721 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.57 -144.89 14.91 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 169.493 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -177.83 139.6 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.353 -0.423 . . . . 0.0 110.367 169.917 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.0 39.35 2.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 -178.966 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -130.95 70.52 0.52 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 -170.082 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.44 118.45 20.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.212 -170.34 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 59.07 -79.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.623 175.667 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.5 t -135.95 -84.38 0.38 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.476 -178.21 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 61.54 175.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.399 169.808 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.7 t -79.32 -22.94 43.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.369 -170.307 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -68.17 144.95 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.377 -169.993 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.583 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.092 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.416 ' HA ' ' OD1' ' A' ' 22' ' ' ASP . 10.1 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -61.01 146.93 45.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.344 -167.402 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.543 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 22.9 t -79.93 129.36 70.77 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.383 -163.86 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.3 Cg_endo -67.88 -18.65 46.93 Favored 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 123.25 2.634 . . . . 0.0 113.497 169.088 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -68.61 0.78 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.251 -166.335 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -94.77 -24.42 17.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.479 -163.358 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t70 73.65 65.88 0.09 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.47 -165.767 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -129.04 -168.47 1.93 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.927 159.573 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.42 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -107.49 147.08 30.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.207 163.52 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.931 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.3 t -105.59 116.47 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.767 -163.741 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -166.85 0.65 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.289 -178.889 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.91 -83.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.48 -167.67 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.83 -12.47 61.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.726 -159.081 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -94.44 17.13 13.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.199 179.894 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.1 ptt-85 -88.53 149.24 23.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.329 -168.249 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 m -148.25 119.54 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.067 161.66 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 42.9 m -93.03 137.16 32.63 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.397 -174.792 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.488 ' C ' HD22 ' A' ' 19' ' ' LEU . 2.0 t -174.33 129.68 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.276 -168.815 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.641 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.98 31.85 20.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.571 -171.781 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.6 61.91 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 166.272 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -147.29 122.57 10.26 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 164.553 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -63.25 -179.82 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.381 -162.011 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.6 m95 -145.78 178.25 8.3 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.742 -178.015 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.931 ' CD2' HG22 ' A' ' 10' ' ' VAL . 48.2 m80 -98.24 146.53 25.54 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.202 -1.363 . . . . 0.0 110.51 171.055 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 tpt180 -62.04 -47.36 90.96 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.719 -171.949 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -62.85 -28.34 75.62 Favored 'Trans proline' 0 N--CA 1.484 0.961 0 C-N-CA 122.491 2.127 . . . . 0.0 113.531 176.915 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.23 -49.43 19.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.136 -165.743 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.825 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -73.03 94.55 1.9 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.341 -160.449 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.34 170.04 15.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.075 163.719 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -60.06 -174.89 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.318 172.144 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -144.65 22.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.65 157.327 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.02 -33.04 1.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.553 -165.106 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.5 p -110.7 -53.01 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.504 163.999 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.24 68.23 0.61 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -169.114 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -144.18 162.69 35.68 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.449 -178.778 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.07 156.49 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.424 169.88 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' A' ' 42' ' ' HIS . 5.8 mt -129.53 173.84 10.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.261 -166.851 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.21 -162.43 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.351 -160.394 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 2.9 p -61.08 -85.44 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.424 -177.863 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.33 48.36 1.03 Allowed Glycine 0 CA--C 1.539 1.543 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 159.498 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.82 -105.85 0.01 OUTLIER Glycine 0 CA--C 1.533 1.162 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 152.443 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.886 ' HB3' HD22 ' A' ' 37' ' ' LEU . 4.3 p80 -58.74 -170.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.862 -0.669 . . . . 0.0 110.806 -163.675 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.579 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -125.55 -166.9 1.61 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.96 160.965 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.498 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -135.73 146.44 47.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.071 -176.31 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -147.48 112.1 5.32 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.759 178.589 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.65 43.1 19.42 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.603 167.739 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.92 46.13 18.24 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 165.629 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 pttt 176.26 97.3 0.1 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -178.184 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.8 144.08 96.62 Favored 'Trans proline' 0 N--CA 1.484 0.955 0 C-N-CA 122.936 2.424 . . . . 0.0 113.555 -167.562 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.9 OUTLIER -131.55 171.18 13.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.728 161.973 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 55.8 m -58.62 145.45 39.6 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 113.836 -1.529 . . . . 0.0 110.81 174.646 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.25 -34.92 75.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.383 -1.28 . . . . 0.0 110.369 175.291 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 33.3 m80 -163.07 165.22 15.04 Favored Pre-proline 0 CA--C 1.549 0.909 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.529 166.729 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -69.89 -6.08 9.43 Favored 'Cis proline' 0 N--CA 1.483 0.881 0 C-N-CA 122.594 -1.836 . . . . 0.0 113.689 -11.523 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 93.2 m -60.37 -50.37 73.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.577 -161.693 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -62.03 -37.86 86.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.351 -172.307 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.24 29.28 7.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.474 175.751 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . -84.21 -68.79 0.69 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.365 171.212 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.0 ttt -86.87 -37.55 17.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.397 -168.569 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -67.64 83.74 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.445 -169.264 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -140.57 -165.79 10.43 Favored Glycine 0 CA--C 1.544 1.885 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -173.818 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -56.4 -57.58 1.37 Allowed 'Trans proline' 0 N--CA 1.484 0.935 0 C-N-CA 122.461 2.107 . . . . 0.0 113.597 -173.964 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.1 mtmp? -66.32 134.18 52.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.407 -169.968 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.7 -151.46 8.81 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 170.609 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' CD2' ' N ' ' A' ' 66' ' ' GLY . 52.8 p90 -96.61 -50.66 4.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.455 . . . . 0.0 110.334 170.117 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 65' ' ' PHE . . . -147.33 -86.49 0.06 OUTLIER Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 170.284 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 65.25 167.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.333 -0.433 . . . . 0.0 110.295 170.271 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.34 133.08 0.06 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 170.613 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -138.25 25.13 2.91 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 170.459 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.27 -82.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.121 -0.539 . . . . 0.0 110.39 172.128 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -169.64 -177.89 2.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.978 -168.667 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 t -107.43 -80.21 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.341 169.329 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 175.12 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.403 170.074 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.89 -74.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.484 170.1 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.14 158.33 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.383 -177.24 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.392 -170.049 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.484 0.955 0 N-CA-C 113.494 0.536 . . . . 0.0 113.494 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 15.3 tttt 65.2 153.58 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.47 165.903 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 15.1 t -72.41 128.61 88.47 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.584 -166.663 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 3.7 Cg_exo -69.99 -7.86 22.17 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.363 2.708 . . . . 0.0 113.39 168.946 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -70.86 0.71 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.276 -173.648 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -97.03 -21.73 17.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.656 -161.152 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t0 73.75 62.98 0.09 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.529 -167.897 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -140.06 166.71 23.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.895 158.947 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.499 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -85.23 152.39 23.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.836 179.609 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' NE2' ' A' ' 24' ' ' HIS . 98.8 t -124.65 125.36 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.334 -164.013 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 12' ' ' PHE . 9.7 t80 -172.23 136.79 0.85 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -159.64 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 11' ' ' TYR . 2.2 m-85 70.64 178.12 0.26 Allowed 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -162.677 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.27 -0.5 10.11 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.584 -155.443 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.31 -18.92 52.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.41 171.081 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.714 ' CB ' HG12 ' A' ' 10' ' ' VAL . 9.8 ptm180 -87.03 127.64 35.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.307 -168.432 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.3 m -127.85 171.33 16.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.091 166.18 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -127.31 137.62 52.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.452 -167.585 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 10.1 t -176.05 126.65 0.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.315 -175.746 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.679 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.22 24.59 13.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.473 -171.622 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.37 -24.76 25.89 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 162.908 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 1.5 mptp? -113.45 132.17 55.75 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.23 -178.263 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 9.1 m-20 -70.47 179.35 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.32 -163.246 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.63 164.8 34.17 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.732 -176.923 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.932 ' NE2' HG22 ' A' ' 10' ' ' VAL . 35.9 m80 -85.35 137.06 33.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.481 164.412 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 3.9 tpm_? -61.21 -49.45 88.16 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.817 -172.651 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.57 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.9 Cg_endo -58.58 -16.7 31.3 Favored 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 122.568 2.179 . . . . 0.0 113.569 174.234 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.88 -49.41 7.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.298 -177.223 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.052 HD21 ' CE1' ' A' ' 42' ' ' HIS . 1.7 tp -62.92 86.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.378 -167.226 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 11.9 mtmt -133.86 163.8 28.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.359 -178.159 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -64.53 157.78 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 168.157 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -126.31 24.91 6.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.997 164.366 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HE2' ' HB2' ' A' ' 58' ' ' ALA . 3.6 tttp -109.29 -64.15 1.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.198 163.01 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -92.8 -19.08 22.1 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.517 -165.084 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.91 53.4 3.53 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 167.554 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -143.93 147.52 34.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.058 -0.571 . . . . 0.0 110.433 179.796 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -61.49 171.64 1.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.508 176.54 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.3 mt -133.14 176.58 8.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.285 -177.498 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -111.03 -174.68 2.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.376 -165.804 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.615 ' H ' HG22 ' A' ' 38' ' ' THR . 29.8 t -61.11 -15.5 33.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.437 -170.02 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.56 67.16 0.03 OUTLIER Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 167.519 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -122.62 11.77 8.92 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 165.775 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 1.052 ' CE1' HD21 ' A' ' 28' ' ' LEU . 28.4 p-80 -97.2 -169.19 1.82 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.876 -0.662 . . . . 0.0 110.369 174.754 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.98 -165.64 2.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.246 166.32 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.434 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 20.3 tt0 -158.32 151.16 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.997 -174.821 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.531 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 2.3 p-80 -93.19 16.26 13.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.562 171.216 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 58.7 72.95 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.675 -169.585 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 167.64 -41.98 0.24 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -179.634 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.85 134.3 4.31 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-O 121.494 0.664 . . . . 0.0 109.652 169.65 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 18.9 Cg_endo -60.62 145.46 98.8 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 C-N-CA 122.42 2.08 . . . . 0.0 113.625 -178.413 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 3.0 m-85 -133.53 -164.81 1.54 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.76 162.268 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 60.1 m -59.09 -171.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.418 167.794 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -99.86 -31.85 11.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.12 163.186 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.5 m80 -168.23 165.3 7.84 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.542 171.652 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.512 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.3 Cg_endo -70.44 -5.58 10.01 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.637 -1.818 . . . . 0.0 113.672 -10.789 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 65.0 m -60.07 -39.75 87.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.494 -161.412 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -67.95 -36.75 80.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.426 -170.957 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.9 p -100.25 21.04 13.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.434 174.768 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.534 ' HB2' ' HE2' ' A' ' 32' ' ' LYS . . . -60.86 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.425 172.12 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.1 ttp -129.41 -25.63 2.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.438 -169.202 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.531 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 23.7 m-85 -74.58 102.6 4.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.359 -168.162 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.16 31.32 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -172.54 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -57.96 129.15 31.84 Favored 'Trans proline' 0 N--CA 1.485 0.982 0 C-N-CA 122.57 2.18 . . . . 0.0 113.519 -173.488 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? 178.6 -72.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.321 169.472 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.18 -171.81 39.01 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 170.357 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -151.65 122.33 7.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.278 -0.461 . . . . 0.0 110.382 170.05 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -153.09 -113.31 0.53 Allowed Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 170.179 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.08 125.88 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.369 170.119 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.22 -139.86 14.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -170.187 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -124.03 -129.53 3.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 170.261 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -173.12 -163.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.409 -0.396 . . . . 0.0 110.281 -169.939 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 58.48 29.87 18.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.603 -168.767 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.64 101.96 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.374 169.375 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -100.45 -70.01 0.75 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.402 169.986 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -146.93 -61.47 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.363 -177.87 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 65.62 146.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.318 -169.891 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.239 0.518 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.347 -170.222 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.486 1.061 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.582 ' HG2' ' HB3' ' A' ' 9' ' ' GLU . 16.5 mtpt 61.94 167.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.379 168.837 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.5 t -80.28 127.36 76.61 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.457 -164.224 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -67.07 -13.86 41.34 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 123.228 2.619 . . . . 0.0 113.465 167.447 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.45 -73.11 0.59 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.41 -172.245 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -91.44 -13.42 32.33 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.479 -168.202 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.11 56.96 3.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.655 -167.99 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 2.5 tttt -110.17 -167.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.965 158.925 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.582 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -107.86 149.57 28.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.263 162.863 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.93 HG22 ' CD2' ' A' ' 24' ' ' HIS . 66.1 t -111.13 113.84 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.921 -166.9 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.07 -168.61 1.32 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.365 175.78 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -72.43 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.451 -165.446 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.77 -1.14 8.41 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.036 -0.666 . . . . 0.0 111.62 -161.076 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.4 17.53 23.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.386 178.348 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 151.97 19.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.311 -165.079 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.813 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.98 145.37 18.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.916 160.151 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 28.2 m -118.9 134.83 54.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -167.56 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.499 ' HB2' ' CE1' ' A' ' 42' ' ' HIS . 20.7 t -178.18 131.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.316 -169.87 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.1 mm? 60.19 20.65 10.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.454 -169.435 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.68 -24.39 28.2 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 165.438 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.39 141.66 45.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.843 -0.678 . . . . 0.0 110.224 -177.593 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.4 177.01 9.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.394 -164.562 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.6 m95 -146.95 179.67 7.44 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.665 -176.181 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.93 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.4 m80 -100.07 136.56 39.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.468 165.424 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HD3' HG11 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -67.77 -47.09 44.8 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.85 -172.121 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -47.72 -38.71 29.89 Favored 'Trans proline' 0 N--CA 1.485 1.006 0 C-N-CA 122.711 2.274 . . . . 0.0 113.46 166.525 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -68.05 -56.41 8.99 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.255 -178.393 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.813 HD22 HG21 ' A' ' 16' ' ' VAL . 5.7 tp -60.46 89.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.37 -163.768 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.0 pttt -132.4 160.01 37.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.36 171.773 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.2 t -60.74 158.69 12.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.276 167.239 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 23.5 pt-20 -134.44 23.55 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.577 159.043 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -36.62 5.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.505 -179.764 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.6 -52.62 2.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.463 164.838 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 114.56 57.86 0.37 Allowed Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 172.027 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -136.82 143.1 42.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.412 168.836 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -61.77 157.59 17.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.475 175.206 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.81 HD13 ' HB2' ' A' ' 42' ' ' HIS . 6.6 mt -116.19 -173.09 2.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.342 -171.013 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.31 -176.72 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.341 -167.363 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 28.2 p -61.58 -21.39 64.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.387 -168.513 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.04 53.63 0.06 OUTLIER Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.728 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.49 10.58 14.44 Favored Glycine 0 CA--C 1.522 0.475 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 167.099 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.81 ' HB2' HD13 ' A' ' 37' ' ' LEU . 13.4 p-80 -86.57 -170.0 2.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.231 -0.485 . . . . 0.0 110.386 174.629 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -154.45 -168.97 3.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.142 166.687 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.7 152.88 3.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.947 -168.45 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.438 ' CB ' ' CE2' ' A' ' 60' ' ' PHE . 85.5 t60 -130.87 73.52 1.55 Allowed 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.97 179.731 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.48 83.63 0.12 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.916 -176.465 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.36 45.93 66.52 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 167.397 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.34 90.11 0.51 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.538 0.685 . . . . 0.0 109.845 169.838 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.89 145.25 99.32 Favored 'Trans proline' 0 N--CA 1.485 1.023 0 C-N-CA 122.514 2.143 . . . . 0.0 113.691 -178.318 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 54.1 m-85 -144.48 -159.8 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.906 167.888 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 36.4 m -55.39 179.61 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.26 170.886 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -105.15 -29.42 10.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.605 157.66 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.38 166.14 16.84 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.276 164.923 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -69.83 -14.69 12.63 Favored 'Cis proline' 0 N--CA 1.482 0.81 0 C-N-CA 122.41 -1.912 . . . . 0.0 113.654 -13.629 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.7 m -59.85 -49.56 77.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.511 -160.032 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.84 -48.73 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.265 -170.812 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.492 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 6.8 m -72.89 -18.74 61.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.383 -174.471 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.98 -59.65 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.264 -170.289 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.9 mmt -65.83 -37.11 85.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.398 -169.924 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.438 ' CE2' ' CB ' ' A' ' 45' ' ' HIS . 28.8 m-85 -93.33 85.24 4.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.377 176.47 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.25 -172.52 23.24 Favored Glycine 0 CA--C 1.544 1.904 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -172.766 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.599 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 6.9 Cg_endo -58.07 -79.66 0.02 OUTLIER 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.503 2.135 . . . . 0.0 113.548 -173.567 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.599 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 2.1 mppt? -138.52 -77.02 0.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.294 -0.867 . . . . 0.0 110.343 -169.508 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.31 -34.34 2.62 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -170.001 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -168.83 -64.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.409 -0.395 . . . . 0.0 110.345 169.925 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 145.1 84.76 0.06 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 170.177 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 mtt-85 61.02 24.88 14.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.431 -0.384 . . . . 0.0 110.424 170.154 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -39.35 2.84 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -178.718 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.46 -77.69 0.23 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.601 -0.999 . . . . 0.0 110.601 -170.12 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.07 -171.72 2.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.274 175.578 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -50.09 67.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.963 -168.897 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -148.93 111.91 4.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.376 169.336 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -67.43 111.51 4.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.342 -169.935 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.58 HG23 ' H ' ' A' ' 75' ' ' PHE . 4.5 t -167.74 -61.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.425 170.041 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.58 ' H ' HG23 ' A' ' 74' ' ' THR . 0.2 OUTLIER -151.79 -57.27 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.374 176.817 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.559 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.276 170.021 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.613 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 21.7 Cg_exo . . . . . 0 N--CA 1.485 0.982 0 N-CA-C 113.569 0.565 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER 66.12 125.84 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.672 165.605 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 21.7 t -93.96 120.83 65.36 Favored Pre-proline 0 C--O 1.245 0.829 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.575 -168.44 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.596 ' HD2' ' CD2' ' A' ' 23' ' ' TRP . 4.3 Cg_exo -75.97 -5.66 16.58 Favored 'Trans proline' 0 N--CA 1.483 0.856 0 C-N-CA 123.201 2.601 . . . . 0.0 113.818 173.628 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.527 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.94 -78.65 0.38 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.573 -179.719 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -77.04 -23.21 52.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.501 -173.016 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 71.89 47.7 0.31 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.475 -173.762 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.7 -168.91 1.61 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.829 159.277 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -108.67 154.65 21.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.708 160.975 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.1 t -114.94 115.36 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.403 -162.894 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -92.17 55.09 2.5 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.852 -156.942 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 67.54 -79.99 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.594 173.668 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.07 0.11 25.91 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.383 -162.48 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -107.0 12.69 28.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.254 175.954 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.05 26.06 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.271 -163.083 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.647 ' CG2' HD22 ' A' ' 28' ' ' LEU . 15.8 m -148.27 121.89 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.843 158.265 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 90.1 m -97.48 136.72 37.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.414 -161.659 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' HD22 ' A' ' 19' ' ' LEU . 23.0 t -178.2 137.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.428 -167.799 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.613 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 60.04 22.11 11.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.625 -171.248 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.05 -23.14 22.31 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 168.797 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 21' ' ' LYS . 14.8 mmmt -122.31 126.73 48.72 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.739 -0.731 . . . . 0.0 110.021 -176.634 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.613 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -60.43 -175.47 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.365 -160.995 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.596 ' CD2' ' HD2' ' A' ' 4' ' ' PRO . 72.5 m95 -146.49 -172.79 4.03 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 112.892 -1.958 . . . . 0.0 109.501 179.127 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.0 m80 -100.75 153.01 19.81 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.612 165.211 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -69.22 -63.85 1.89 Allowed Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.788 179.943 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -50.84 -17.56 3.37 Favored 'Trans proline' 0 N--CA 1.485 1.013 0 C-N-CA 122.301 2.001 . . . . 0.0 113.455 177.337 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -80.99 -52.89 6.94 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.394 178.692 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.907 HD21 ' CE1' ' A' ' 42' ' ' HIS . 2.9 tp -72.98 82.84 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.319 -163.952 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -138.45 172.07 13.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.304 167.931 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -67.97 157.68 34.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.357 174.297 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.36 23.67 5.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.749 161.399 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.417 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -116.95 -41.36 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.471 -171.45 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -110.98 -52.44 2.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.782 173.264 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.05 59.01 0.25 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 173.076 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.0 mtpp -149.07 168.28 23.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.408 -177.568 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' LEU . 8.0 m -92.87 168.05 11.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.381 -178.78 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.745 HD13 ' CB ' ' A' ' 42' ' ' HIS . 4.1 mt -131.65 131.45 43.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.419 -167.563 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -155.91 -170.15 3.31 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.232 173.014 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.507 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER 63.42 14.74 8.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.026 -163.45 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.31 45.89 95.3 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 -162.734 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -94.13 9.9 72.13 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 -163.385 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.907 ' CE1' HD21 ' A' ' 28' ' ' LEU . 30.4 p-80 -106.32 -171.6 1.93 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.142 0.496 . . . . 0.0 110.545 -173.656 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -176.37 159.63 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.134 175.74 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.423 ' HG2' HD11 ' A' ' 19' ' ' LEU . 1.1 pt-20 -109.47 140.7 42.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.961 -165.134 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.491 ' CE1' ' CD1' ' A' ' 60' ' ' PHE . 43.3 t60 -94.41 41.22 1.09 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.797 1.284 . . . . 0.0 109.506 161.89 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.5 98.78 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.622 -171.833 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.22 37.22 43.03 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 168.4 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mttt 179.95 96.31 0.19 Allowed Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.238 0.542 . . . . 0.0 109.724 172.892 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -63.52 146.5 92.94 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 C-N-CA 122.754 2.302 . . . . 0.0 113.546 -173.521 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -145.13 -162.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.938 166.411 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.7 m -57.52 179.45 0.06 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.724 167.925 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.54 -27.56 12.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.066 161.426 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.535 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 33.4 m80 -164.83 166.99 10.47 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.464 170.178 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.674 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 11.5 Cg_endo -68.69 -7.94 8.47 Favored 'Cis proline' 0 N--CA 1.482 0.834 0 C-N-CA 122.513 -1.87 . . . . 0.0 113.702 -12.693 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.1 m -60.48 -52.71 64.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.417 -162.461 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -60.72 -33.37 72.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.394 -168.366 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.08 26.78 10.26 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.322 179.97 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . -94.79 -66.73 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.323 178.783 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 32.7 mtt -107.87 -27.89 9.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.396 -167.548 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.491 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -75.06 90.37 2.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.321 -170.154 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 177.62 72.72 0.06 OUTLIER Glycine 0 CA--C 1.544 1.88 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 -172.559 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -56.98 -53.89 4.4 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.518 2.145 . . . . 0.0 113.545 -172.223 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.41 -77.48 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.361 -169.004 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.27 156.64 26.81 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 170.094 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -126.39 -177.48 4.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.344 170.059 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -141.21 111.56 0.72 Allowed Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -170.09 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.75 32.88 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.338 -0.431 . . . . 0.0 110.371 169.959 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 150.99 44.27 0.02 OUTLIER Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -178.869 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -119.28 83.63 0.36 Allowed Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 170.286 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -147.64 21.48 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.359 169.857 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.8 -53.3 57.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.992 -168.78 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -155.08 -41.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.382 174.329 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 66.09 25.44 10.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.391 -169.696 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.6 p -60.82 -86.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.42 170.261 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -105.73 -75.99 0.62 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.294 -0.867 . . . . 0.0 110.348 -169.858 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.58 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.38 178.407 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 11.9 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 160.89 30.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.406 -168.57 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.2 t -81.15 130.82 61.29 Favored Pre-proline 0 C--O 1.246 0.872 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.461 -162.689 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -69.08 -18.13 40.33 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 123.379 2.719 . . . . 0.0 113.368 166.908 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 -70.9 0.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.381 -167.301 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.1 p -91.65 -24.17 19.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.432 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 73.03 54.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.505 -167.609 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 4.2 tptp -112.64 -169.27 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.822 158.409 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -109.52 150.97 27.37 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.526 161.386 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -107.74 114.9 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.63 -165.439 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -101.36 56.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.023 0.915 . . . . 0.0 110.079 -158.906 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.27 -80.59 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.354 170.8 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.02 -6.37 56.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.414 -157.615 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -114.09 41.66 2.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.082 163.502 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -86.45 149.16 25.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.367 177.758 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.429 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -147.12 122.4 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.623 158.392 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.6 m -100.02 136.89 39.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.399 -162.252 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.7 t -177.67 127.18 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.307 -166.361 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 60.12 29.79 19.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.699 -171.758 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.51 17.19 47.17 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 167.57 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.24 119.33 12.75 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 164.903 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 17.4 m-20 -62.03 -178.21 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.396 -159.291 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 51.2 m95 -146.47 -174.41 4.45 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 113.838 -1.528 . . . . 0.0 109.473 179.42 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.3 m80 -100.57 154.61 18.43 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.59 172.021 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.547 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.84 -56.75 29.26 Favored Pre-proline 0 C--O 1.241 0.634 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.851 -173.851 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.8 Cg_exo -64.01 -27.87 66.09 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 122.695 2.263 . . . . 0.0 113.545 -179.178 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -69.95 -53.49 17.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.218 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.911 HD21 ' CD2' ' A' ' 42' ' ' HIS . 2.2 tp -60.04 100.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.434 -159.082 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.446 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 4.5 mttt -132.64 147.28 52.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.217 -170.037 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -59.79 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.337 168.554 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.9 tt0 -146.47 25.41 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.753 157.722 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.11 -38.34 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.522 -169.045 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -104.88 -31.59 9.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.32 165.19 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 56.15 1.9 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 160.439 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.61 175.36 3.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.369 161.416 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.622 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -60.39 179.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.44 -162.095 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.756 HD13 ' HB3' ' A' ' 42' ' ' HIS . 6.8 mt -131.73 -172.18 2.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.3 -173.973 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 92.1 m -123.95 137.82 54.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 -176.025 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 t 59.69 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.558 165.372 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.58 44.1 0.18 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 160.224 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.08 11.08 56.35 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.878 -0.661 . . . . 0.0 111.553 -175.705 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.911 ' CD2' HD21 ' A' ' 28' ' ' LEU . 8.1 p80 -90.56 -169.49 2.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.897 -0.651 . . . . 0.0 110.39 172.041 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -154.27 154.45 33.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.14 166.837 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.505 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -100.3 146.92 26.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.155 -178.742 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 86.1 t60 -87.7 -45.88 9.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.813 166.1 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.82 79.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.009 166.264 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.78 -23.29 33.45 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 175.077 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 97.79 25.38 Favored Pre-proline 0 C--O 1.244 0.776 0 CA-C-N 115.003 -0.599 . . . . 0.0 109.697 -173.976 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.446 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 16.0 Cg_endo -65.77 142.05 68.26 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.629 2.219 . . . . 0.0 113.711 -170.161 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 1.9 m-85 -135.41 167.29 21.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.399 163.486 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 42.9 m -59.53 153.7 19.04 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 113.725 -1.58 . . . . 0.0 110.448 172.741 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -61.81 -45.91 91.79 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.321 179.001 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.5 m-70 -158.36 163.58 23.96 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.517 169.025 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -71.49 -3.8 10.76 Favored 'Cis proline' 0 N--CA 1.483 0.891 0 C-N-CA 122.748 -1.772 . . . . 0.0 113.817 -9.168 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 88.3 m -60.06 -59.16 5.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.407 -160.982 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -60.63 -40.74 93.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.454 -169.301 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.52 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 13.3 p -64.81 -21.29 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.422 176.835 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . -66.28 -44.31 83.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.228 -169.149 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -91.57 -49.02 6.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.439 168.399 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 8.0 m-85 -119.8 81.94 1.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.277 -171.634 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.471 ' HA2' ' HA ' ' A' ' 57' ' ' SER . . . -118.74 141.1 15.75 Favored Glycine 0 CA--C 1.543 1.822 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -170.261 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.97 -33.24 96.93 Favored 'Trans proline' 0 N--CA 1.482 0.85 0 C-N-CA 122.601 2.2 . . . . 0.0 113.652 172.488 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -82.02 -57.78 3.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.289 -169.136 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.87 95.39 0.09 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.959 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.7 p90 56.82 83.71 0.1 Allowed 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 122.188 -0.595 . . . . 0.0 111.844 177.251 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -143.83 73.11 0.35 Allowed Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 175.512 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -143.99 -73.35 0.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.427 170.012 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -154.68 -174.37 24.6 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.613 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.82 -58.84 0.03 OUTLIER Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -170.406 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.7 147.99 47.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.347 -0.427 . . . . 0.0 110.201 -169.954 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -164.33 122.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.113 169.009 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 m -78.52 -83.89 0.08 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.38 -169.385 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.21 145.92 52.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.393 -170.046 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.95 -55.53 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.427 170.133 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.84 -79.38 0.33 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.341 169.939 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.645 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.419 178.443 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.042 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -146.72 134.94 21.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.318 -169.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.4 t -84.38 114.94 57.96 Favored Pre-proline 0 C--O 1.25 1.123 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.158 -163.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -59.82 -20.54 59.73 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.787 2.325 . . . . 0.0 113.278 170.191 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -73.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.389 -175.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -93.55 -21.46 19.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.558 -165.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 72.61 57.22 0.13 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.47 -171.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.23 -168.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.99 159.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.46 152.24 22.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.572 162.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.9 t -112.09 112.35 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.627 -163.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 17.4 t80 -69.05 153.34 43.94 Favored 'General case' 0 N--CA 1.458 -0.038 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.285 176.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.495 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 2.7 m-85 -60.44 -62.05 2.15 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.835 -159.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.41 10.61 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.644 -173.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -102.55 13.95 33.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.449 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.0 154.72 17.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.228 -161.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.25 151.98 14.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.748 156.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.58 136.48 52.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.616 -169.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.9 t -174.83 131.83 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.185 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.593 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.1 mm? 60.04 34.52 21.39 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.558 -170.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.08 18.18 57.0 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 169.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -137.75 154.01 49.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 164.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.434 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.5 m-20 -88.14 176.9 7.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.367 -166.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -148.96 -177.25 5.7 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.251 -1.341 . . . . 0.0 109.074 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.7 m80 -99.54 143.22 30.03 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.475 169.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.71 -45.15 96.94 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.844 -167.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.3 Cg_endo -64.05 -36.46 48.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.589 2.192 . . . . 0.0 113.669 174.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.48 -46.71 84.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.233 -165.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 42' ' ' HIS . 4.3 tp -62.77 83.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.367 -166.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -142.21 149.72 40.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.425 -166.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -65.5 127.59 32.46 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.472 175.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 1.2 tt0 -95.97 22.53 7.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.255 -1.338 . . . . 0.0 110.177 171.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 -58.98 2.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.318 169.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.2 p -104.81 -19.94 13.75 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.851 -170.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.89 37.19 34.14 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 176.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -96.1 128.12 42.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.496 -0.352 . . . . 0.0 110.335 167.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.2 m -61.14 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 42' ' ' HIS . 57.1 mt -98.08 167.22 11.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.378 -164.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 39' ' ' SER . 59.4 m -125.28 173.78 8.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.228 -164.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.574 ' N ' HG22 ' A' ' 38' ' ' THR . 1.0 OUTLIER -61.13 91.96 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.48 -178.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.53 57.1 8.54 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.22 12.78 3.55 Favored Glycine 0 CA--C 1.524 0.597 0 CA-C-N 114.757 -0.721 . . . . 0.0 111.701 166.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.658 ' HB2' HD13 ' A' ' 37' ' ' LEU . 6.9 p80 -110.86 -168.96 1.37 Allowed 'General case' 0 C--O 1.231 0.084 0 CA-C-N 114.762 -0.719 . . . . 0.0 110.594 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.95 158.52 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.69 165.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -110.09 124.93 52.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.974 -160.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.499 ' HB3' ' HG3' ' A' ' 48' ' ' LYS . 86.3 t60 -99.53 163.07 12.66 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.121 158.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.46 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 16.4 mp0 -60.31 92.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.241 -160.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.89 45.99 15.09 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.586 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HG3' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -177.97 104.81 0.21 Allowed Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 121.6 0.714 . . . . 0.0 109.956 169.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -61.77 172.57 3.63 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.603 2.202 . . . . 0.0 113.668 167.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 63.5 m-85 -169.11 177.55 4.8 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.01 -171.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 83.9 m -58.21 140.69 52.57 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.136 -1.393 . . . . 0.0 110.066 160.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.73 -38.94 86.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.191 164.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 12.3 m-70 -153.21 173.45 4.59 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.342 165.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.8 Cg_endo -62.59 -18.71 4.6 Favored 'Cis proline' 0 N--CA 1.494 1.504 0 C-N-CA 121.248 -2.397 . . . . 0.0 112.537 -23.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.1 m -57.49 -41.69 81.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.146 -154.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -60.93 -48.02 83.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.412 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 24.8 t -72.03 -18.07 61.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.437 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.288 -171.053 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.427 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 14.4 Cg_exo . . . . . 0 N--CA 1.485 1.012 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.85 140.82 21.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.386 -167.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.7 t -86.96 116.47 66.17 Favored Pre-proline 0 C--O 1.25 1.108 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.104 -163.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.7 Cg_endo -59.51 -18.08 44.76 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 C-N-CA 122.784 2.322 . . . . 0.0 113.233 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -84.06 -69.44 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.466 -171.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.95 -21.92 18.3 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.638 -168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 t70 72.29 53.33 0.18 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.457 -171.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -111.7 -168.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.981 159.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.49 152.33 23.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.724 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.3 t -112.2 111.23 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.633 -163.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -73.65 157.63 36.24 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.287 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.17 -62.32 1.95 Allowed 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -158.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.62 -12.34 61.5 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.723 -173.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 1.6 mp0 -102.31 44.75 0.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.058 170.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -111.2 150.17 29.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.412 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.45 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -140.74 146.34 24.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.528 155.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -115.46 138.35 51.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.748 -166.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -178.19 132.09 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.22 -171.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.05 20.67 9.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.572 -171.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.85 -24.41 21.16 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 170.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -105.17 154.55 20.05 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 114.87 -0.665 . . . . 0.0 110.137 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -92.2 176.89 6.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.375 -165.258 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 24.1 m95 -150.49 -175.14 4.98 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.233 -1.348 . . . . 0.0 108.971 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.4 m80 -100.13 150.27 22.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 113.963 -1.471 . . . . 0.0 110.624 168.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 22.6 mtp180 -61.32 -56.56 32.76 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.922 -170.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 5.9 Cg_endo -58.77 -36.92 96.33 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.413 2.075 . . . . 0.0 113.567 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.81 -46.36 90.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.285 -164.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.653 HD12 ' HG3' ' A' ' 49' ' ' PRO . 7.8 tp -60.02 89.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.236 -160.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.1 tttp -138.4 146.57 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.307 -162.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -66.2 123.64 20.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.446 171.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB2' ' HE3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -96.72 36.95 1.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.954 168.615 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.84 -44.38 0.88 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.208 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.8 p -116.7 -21.62 8.99 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.006 176.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.94 44.51 11.94 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -105.39 131.06 53.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.422 170.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.2 m -61.0 147.35 43.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.368 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.588 HD13 ' CB ' ' A' ' 42' ' ' HIS . 60.7 mt -110.93 173.99 6.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.331 -168.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.592 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -122.01 -175.61 3.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.381 -167.054 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG22 ' A' ' 38' ' ' THR . 16.7 t -66.71 -18.94 65.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.376 -167.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.9 62.91 0.08 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 171.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -129.15 12.33 6.08 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.588 ' CB ' HD13 ' A' ' 37' ' ' LEU . 5.8 p80 -103.87 -168.91 1.56 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.981 -0.609 . . . . 0.0 110.436 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.1 158.61 7.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.966 161.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.512 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 4.4 tt0 -115.19 121.31 42.57 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.015 -160.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.451 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -75.0 151.17 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.572 157.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.72 76.37 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.931 -176.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.39 -59.52 0.3 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -163.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.53 ' HE3' ' HB2' ' A' ' 31' ' ' GLU . 14.0 mtpp -155.32 140.19 12.05 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-O 121.339 0.59 . . . . 0.0 110.052 -160.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.653 ' HG3' HD12 ' A' ' 28' ' ' LEU . 12.2 Cg_endo -66.04 154.15 75.21 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.958 2.439 . . . . 0.0 113.568 165.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 28.7 m-85 -149.02 -167.24 2.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.84 166.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.6 m -57.7 134.24 56.04 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.287 166.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -68.22 -32.09 72.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.909 159.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.533 ' CG ' ' HB2' ' A' ' 57' ' ' SER . 11.9 m-70 -150.96 163.42 23.77 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.338 165.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -68.44 -22.53 8.56 Favored 'Cis proline' 0 N--CA 1.487 1.129 0 C-N-CA 122.427 -1.905 . . . . 0.0 112.798 -18.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 85.6 m -56.99 -43.02 81.32 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.214 -153.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -69.5 -37.8 77.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.471 170.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.533 ' HB2' ' CG ' ' A' ' 53' ' ' HIS . 48.1 t -60.77 -17.61 50.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.48 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.187 -167.967 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.466 0.525 . . . . 0.0 113.466 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -122.23 157.61 31.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.469 -175.006 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -84.92 119.92 73.14 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.246 -161.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -61.55 -25.02 78.93 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.778 2.319 . . . . 0.0 113.236 169.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -75.43 -74.36 0.21 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.421 -176.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -91.67 -22.41 20.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.608 -166.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 72.72 51.92 0.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.575 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.52 -169.01 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.841 158.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.3 155.0 19.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.449 160.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 47.9 t -112.29 112.13 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.666 -165.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.19 164.34 26.18 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.273 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.35 -62.4 1.9 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 -159.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -12.94 61.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.712 -173.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -101.22 44.55 1.01 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.093 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.54 144.57 40.55 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.483 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.12 119.65 5.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.606 154.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 95.9 m -99.97 141.49 32.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.365 -163.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.659 ' OG ' HD13 ' A' ' 19' ' ' LEU . 28.5 t -170.13 133.87 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.275 -163.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 ' OG ' ' A' ' 18' ' ' SER . 6.8 mp 59.87 18.34 7.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.471 161.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.66 -24.2 8.1 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 164.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -140.05 158.17 44.48 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.218 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.6 m-20 -84.31 178.33 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.301 -165.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 48.9 m95 -147.91 -174.69 4.63 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 113.689 -1.596 . . . . 0.0 109.486 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.6 m80 -99.92 157.81 16.26 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.198 -1.364 . . . . 0.0 110.659 170.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.573 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 ttp180 -66.83 -60.03 6.93 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.817 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -60.39 -20.43 63.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.394 2.063 . . . . 0.0 113.723 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.56 -54.64 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.19 -169.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 37' ' ' LEU . 1.3 tp -65.05 84.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.327 -163.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.58 148.62 52.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 -170.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.6 t -64.76 127.79 33.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.392 172.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -95.8 34.22 1.55 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.049 171.454 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -56.2 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.426 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.5 p -104.67 -17.93 14.48 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.085 -174.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.05 39.88 44.42 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 174.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -118.79 138.07 52.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.991 -0.605 . . . . 0.0 110.449 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -68.39 159.99 30.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.382 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.5 mt -124.91 123.47 39.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.468 -170.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.62 -168.05 2.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.528 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.9 t -76.01 73.06 2.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.395 -168.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.61 55.36 0.95 Allowed Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 167.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.78 12.77 5.61 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 162.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.6 p80 -114.14 -168.6 1.38 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.24 -177.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.96 157.84 16.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.874 160.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.634 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -112.7 131.19 55.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.035 -161.102 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.458 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.4 t60 -96.44 163.56 13.0 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.371 160.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.458 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 11.5 tp10 -60.79 92.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.108 -162.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 55.25 7.55 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.614 -170.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 176.28 102.98 0.1 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 121.447 0.642 . . . . 0.0 109.876 165.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 18.0 Cg_endo -65.28 149.82 88.03 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.714 2.276 . . . . 0.0 113.627 169.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 50.6 m-85 -143.44 -178.84 6.07 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.007 169.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.5 m -56.23 138.95 49.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 113.49 -1.686 . . . . 0.0 110.802 165.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.7 -31.72 70.99 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.036 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.44 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 27.3 m-70 -161.37 162.38 21.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 CA-C-N 114.715 -1.129 . . . . 0.0 109.251 165.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -73.36 -13.27 19.53 Favored 'Cis proline' 0 N--CA 1.483 0.856 0 C-N-CA 122.65 -1.812 . . . . 0.0 113.609 -13.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 80.7 m -59.5 -42.01 91.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.72 -156.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -66.44 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.306 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -60.64 -11.64 7.88 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.42 -169.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.352 176.306 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.46 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 12.2 Cg_endo . . . . . 0 N--CA 1.485 1.025 0 N-CA-C 113.612 0.581 . . . . 0.0 113.612 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -142.28 151.16 41.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.5 172.07 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.9 t -88.01 117.74 68.8 Favored Pre-proline 0 C--O 1.251 1.155 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.253 -162.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -59.72 -22.1 66.09 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.732 2.288 . . . . 0.0 113.171 169.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -74.09 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.441 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.61 -21.26 19.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.61 -164.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.43 58.58 0.13 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.452 -170.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.15 -168.56 1.54 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.01 160.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.8 mt-10 -105.76 152.57 23.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.63 161.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -112.44 113.09 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.595 -162.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -72.84 156.27 39.06 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.371 177.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -60.35 -62.3 1.97 Allowed 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.839 -159.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -1.4 10.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.736 -173.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -102.57 14.46 31.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.422 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.96 152.86 18.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.306 -161.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.634 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.5 153.56 13.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.65 156.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.33 142.69 35.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.767 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.457 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 38.7 t -177.46 133.35 0.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.284 172.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.523 ' HB3' ' HZ2' ' A' ' 21' ' ' LYS . 3.3 mm? 59.96 32.21 21.03 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.537 -172.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.86 18.34 68.43 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 167.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HZ2' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -140.4 155.11 46.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 165.339 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.46 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.6 m-20 -86.6 176.99 7.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.305 -164.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -149.27 -175.49 5.0 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.196 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.3 m80 -100.6 140.61 34.62 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.527 169.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.685 HH12 HG21 ' A' ' 36' ' ' THR . 17.3 tpt85 -62.02 -46.52 91.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 115.206 -0.907 . . . . 0.0 109.871 -173.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.0 Cg_exo -50.01 -39.62 50.17 Favored 'Trans proline' 0 N--CA 1.484 0.967 0 C-N-CA 122.724 2.283 . . . . 0.0 113.418 169.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.81 -47.62 37.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.268 -164.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.802 HD21 ' CD2' ' A' ' 42' ' ' HIS . 4.1 tp -66.16 77.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.488 -170.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 29' ' ' LYS . 15.5 ptmt -138.31 141.42 39.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.393 -171.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.5 t -60.26 122.01 13.43 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 172.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 20.0 mt-10 -96.88 38.59 1.22 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.166 167.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -39.1 0.76 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.382 -177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.8 p -120.6 -27.57 5.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.056 172.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.29 47.15 5.58 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.534 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -104.25 130.58 52.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.416 167.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.685 HG21 HH12 ' A' ' 25' ' ' ARG . 85.9 m -64.39 146.83 53.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.373 167.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.0 mt -114.89 131.03 56.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.401 -167.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -78.98 -167.86 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.482 168.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -65.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.453 -168.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -127.49 56.9 0.72 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.72 10.3 3.7 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 114.997 -0.602 . . . . 0.0 111.89 166.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.802 ' CD2' HD21 ' A' ' 28' ' ' LEU . 27.2 p80 -108.75 -170.16 1.62 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 111.026 -175.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.418 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -146.57 -163.21 1.7 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.845 168.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -171.12 132.83 0.84 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.302 174.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -95.24 159.3 15.08 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 154.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.68 90.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.018 -161.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.87 -44.09 1.21 Allowed Glycine 0 CA--C 1.53 1.004 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.733 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 7.2 mtmm -132.28 108.53 13.63 Favored Pre-proline 0 C--O 1.243 0.74 0 CA-C-O 121.139 0.495 . . . . 0.0 109.81 -159.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 16.1 Cg_endo -67.75 155.87 68.22 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 123.115 2.543 . . . . 0.0 113.648 165.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.3 m-85 -152.62 -162.16 1.44 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.858 169.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.3 m -57.45 139.09 54.16 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.316 162.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.61 -34.67 74.56 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.103 164.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.542 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.1 m-70 -158.56 173.1 5.31 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.386 164.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.527 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.1 Cg_endo -63.23 -18.95 5.13 Favored 'Cis proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.466 -2.306 . . . . 0.0 112.603 -22.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.4 m -57.33 -40.36 77.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.219 -154.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -60.93 -48.31 82.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.309 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.542 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -65.52 -18.31 65.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.644 177.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.126 -165.835 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HD2' ' HE3' ' A' ' 21' ' ' LYS . 3.1 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.545 0.556 . . . . 0.0 113.545 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HG2' ' N ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -119.39 142.87 47.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.339 -169.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.9 t -78.72 118.68 73.81 Favored Pre-proline 0 C--O 1.252 1.207 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.47 -162.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -61.8 -12.0 23.43 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 123.011 2.474 . . . . 0.0 113.479 170.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.576 ' HD2' ' HD2' ' A' ' 49' ' ' PRO . 3.7 ttpp -93.52 -77.08 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.58 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.8 p -88.5 -19.47 26.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.985 -163.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.72 56.16 0.18 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.497 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.05 -172.57 2.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.013 161.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -97.55 152.78 18.67 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.68 166.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -116.34 111.71 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.549 -163.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.7 158.56 31.99 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.367 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.36 -65.86 0.62 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.803 -159.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -12.51 61.62 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.701 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.97 46.72 0.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.95 168.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.7 ptt85 -118.56 149.91 40.55 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.77 170.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 28' ' ' LEU . 19.3 m -138.62 149.25 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.554 157.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -114.06 136.99 52.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.475 -163.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 24.3 t -178.23 135.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.393 -170.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.98 17.91 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.717 -176.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.36 -24.89 30.38 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 166.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' HD2' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -114.98 164.9 13.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.843 -0.679 . . . . 0.0 110.07 179.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 3.8 m-20 -90.8 177.44 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.283 -165.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.0 m95 -153.03 173.72 15.07 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 113.907 -1.497 . . . . 0.0 108.99 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.7 m80 -92.08 142.65 27.28 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.466 174.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.18 -49.87 86.49 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.793 -172.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.6 Cg_endo -58.29 -41.02 70.66 Favored 'Trans proline' 0 N--CA 1.484 0.915 0 C-N-CA 122.551 2.168 . . . . 0.0 113.613 172.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.535 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.5 m -61.1 -48.13 83.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.213 -171.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.819 HD11 ' CE1' ' A' ' 42' ' ' HIS . 4.2 tp -67.71 94.3 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.379 -167.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.449 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.7 ttmt -153.16 149.46 28.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.471 -171.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -73.24 122.72 22.39 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.372 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -97.78 42.03 1.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.042 167.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 13.3 tptp -132.3 -49.87 0.93 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.328 172.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -109.26 -31.35 7.6 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.763 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.17 49.16 5.39 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -104.04 132.47 50.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.405 -0.397 . . . . 0.0 110.346 161.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.414 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 9.2 m -60.56 136.97 58.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.345 166.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 39.8 mt -97.89 169.66 9.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.315 -163.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.5 -174.97 2.66 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.355 -161.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -72.83 67.89 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.316 165.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.94 53.62 2.81 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 172.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.39 12.24 8.45 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 160.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.819 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.5 p80 -110.62 -169.61 1.49 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 114.911 -0.644 . . . . 0.0 110.469 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.425 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.55 -163.28 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.72 165.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.4 pp20? -155.32 139.29 16.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.189 169.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.496 ' CD2' ' HG2' ' A' ' 46' ' ' GLU . 41.2 t60 -124.59 104.32 8.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.058 172.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.496 ' HG2' ' CD2' ' A' ' 45' ' ' HIS . 6.5 mm-40 58.59 43.35 19.23 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.799 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 99.84 -20.16 50.37 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 168.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.71 99.73 14.36 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.412 0.625 . . . . 0.0 109.867 -167.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.576 ' HD2' ' HD2' ' A' ' 5' ' ' LYS . 9.7 Cg_endo -66.1 153.9 76.25 Favored 'Trans proline' 0 N--CA 1.484 0.948 0 C-N-CA 122.429 2.086 . . . . 0.0 113.602 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 38.3 m-85 -151.46 -165.75 2.33 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.04 167.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.6 m -57.61 132.26 52.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.99 -1.459 . . . . 0.0 110.395 165.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.86 -36.27 78.74 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.917 162.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 22.5 m-70 -152.8 168.49 11.32 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.134 161.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 20.1 Cg_endo -67.57 -22.79 7.88 Favored 'Cis proline' 0 N--CA 1.489 1.232 0 C-N-CA 122.43 -1.904 . . . . 0.0 112.838 -17.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.4 m -56.96 -41.2 77.9 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.286 -153.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.39 -61.39 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.368 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -92.38 23.96 3.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.516 -166.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.354 172.345 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.575 ' H2 ' ' HE2' ' A' ' 2' ' ' LYS . 1.1 Cg_endo . . . . . 0 N--CA 1.487 1.12 0 N-CA-C 113.5 0.539 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.575 ' HE2' ' H2 ' ' A' ' 1' ' ' PRO . 3.4 mmtt -130.72 139.48 50.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.378 172.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 28.7 t -82.92 122.84 78.19 Favored Pre-proline 0 C--O 1.25 1.097 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.178 -162.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -62.63 -30.97 79.54 Favored 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.99 2.46 . . . . 0.0 113.23 169.015 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -71.08 0.23 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.394 -176.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.9 -22.75 16.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.601 -164.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 72.4 68.37 0.13 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.456 -168.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 -168.23 1.91 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.208 162.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.69 151.41 23.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.341 164.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 62.9 t -120.41 111.25 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.846 -162.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.0 163.6 25.74 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.431 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.57 -59.44 5.4 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.887 -160.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.641 -176.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.644 ' O ' HG13 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -108.03 37.87 2.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.058 166.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.801 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -118.69 131.84 56.15 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.943 163.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 28' ' ' LEU . 19.9 m -112.04 167.62 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.508 156.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 m -126.58 138.03 53.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.546 -167.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 35.6 t -177.42 137.5 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.395 -177.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.516 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 60.01 17.94 7.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.689 -177.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.13 -24.95 29.48 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.569 -1.013 . . . . 0.0 110.569 166.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.0 160.84 19.11 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 114.883 -0.658 . . . . 0.0 110.129 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.4 m-20 -88.42 177.03 6.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.271 -165.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -150.15 163.14 38.98 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.067 -1.424 . . . . 0.0 109.362 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -82.88 138.45 33.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.347 170.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.91 -46.69 96.81 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.779 -169.083 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_exo -54.59 -43.8 55.59 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 122.697 2.265 . . . . 0.0 113.537 169.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.83 -49.81 74.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.306 -169.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.539 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -68.16 88.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.376 -168.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.3 142.47 27.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.333 -169.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -60.12 122.13 13.65 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.466 171.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.578 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 27.1 mt-10 -96.32 38.23 1.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.964 165.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.79 -50.84 1.24 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.046 175.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.9 p -112.08 -20.42 11.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.874 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.8 44.4 20.03 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -100.58 127.18 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.335 169.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 72.0 m -61.44 139.8 58.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.412 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 42' ' ' HIS . 77.9 mt -104.32 116.55 32.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.292 -169.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -118.57 -171.23 2.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.531 -172.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 t 57.83 -90.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.098 163.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.36 43.15 0.07 OUTLIER Glycine 0 CA--C 1.533 1.18 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 161.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.7 24.24 15.62 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -167.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 37' ' ' LEU . 7.7 p80 -101.16 -169.41 1.69 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.597 -0.802 . . . . 0.0 110.52 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.38 158.32 7.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.816 162.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp20? -115.05 133.65 55.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.025 -159.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.437 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 69.2 t60 -102.7 162.64 12.76 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 157.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.437 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 3.9 mm-40 -60.67 90.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.169 -161.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.77 -19.08 12.56 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.757 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -141.1 105.37 6.13 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-O 121.254 0.55 . . . . 0.0 109.773 -162.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.6 Cg_endo -66.43 161.08 42.54 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.872 2.381 . . . . 0.0 113.62 165.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -159.14 -171.18 3.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.0 173.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.5 m -58.08 139.54 54.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 113.666 -1.606 . . . . 0.0 110.321 165.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -60.36 -35.44 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.261 164.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 11.5 m-70 -156.35 171.3 7.54 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.378 167.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 25.2 Cg_endo -62.65 -18.11 4.64 Favored 'Cis proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.135 -2.444 . . . . 0.0 112.539 -24.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.2 m -57.61 -41.74 81.86 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.129 -154.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -61.06 -60.02 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.294 174.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.448 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -70.97 -11.4 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.433 -168.577 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.372 177.061 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.484 0.97 0 N-CA-C 113.571 0.566 . . . . 0.0 113.571 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -123.88 146.98 48.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.466 -169.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.2 t -83.41 117.0 67.36 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.275 -165.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.608 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.63 -22.08 73.57 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.786 2.324 . . . . 0.0 113.238 169.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.44 -73.57 0.27 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.451 -175.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -92.11 -22.54 19.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.526 -167.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t0 72.99 60.48 0.1 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.555 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.45 -169.23 1.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.068 159.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.76 153.1 18.49 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.477 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.7 t -112.71 112.98 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.573 -167.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -69.0 152.69 44.93 Favored 'General case' 0 C--N 1.335 -0.065 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.212 175.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -59.97 4.55 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.712 -158.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.86 -0.29 10.92 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.581 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.42 15.49 28.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.336 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -96.89 153.41 17.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.248 -161.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.61 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -146.2 149.16 16.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.692 157.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.72 136.82 48.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.753 -169.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.444 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.45 138.77 0.23 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.31 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.46 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 59.98 23.95 13.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.663 -176.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.16 -24.78 28.6 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 166.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -115.43 163.5 15.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.793 -0.704 . . . . 0.0 110.247 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.466 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.73 176.02 7.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.418 -168.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.608 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 32.2 m95 -147.28 -177.54 5.74 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.115 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -102.42 141.06 35.85 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.521 169.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.563 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 11.5 mtm180 -60.88 -50.84 83.21 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.896 -171.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 7.0 Cg_exo -50.54 -36.83 50.86 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.386 2.057 . . . . 0.0 113.521 171.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.34 -52.28 23.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.372 -168.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 42' ' ' HIS . 3.9 tp -64.4 92.23 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.374 -167.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.452 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 pttp -150.15 147.97 28.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.455 -170.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -64.65 121.42 14.44 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.29 171.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.474 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -95.36 44.91 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.033 163.562 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -137.18 -45.26 0.56 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.352 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.6 p -115.62 -33.53 5.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.924 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.45 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 81.67 50.15 5.11 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.72 129.1 55.92 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.248 158.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.8 m -61.3 136.95 58.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.286 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 14.9 mt -92.09 134.61 34.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.351 -161.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.71 HG22 ' OG ' ' A' ' 39' ' ' SER . 80.2 m -97.37 146.36 25.25 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.937 175.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.71 ' OG ' HG22 ' A' ' 38' ' ' THR . 28.3 m 61.24 -156.14 0.35 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.952 159.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -89.99 54.92 3.67 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 156.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -105.45 14.08 47.12 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.789 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.8 p80 -113.1 -167.39 1.18 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-N 113.927 -1.137 . . . . 0.0 110.469 173.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.89 159.87 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.301 160.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.449 ' CG ' ' HG ' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -126.1 122.65 36.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.069 -165.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -92.65 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.935 161.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.46 42.25 21.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.832 170.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 23.59 61.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -119.54 84.78 30.72 Favored Pre-proline 0 CA--C 1.541 0.621 0 CA-C-O 121.547 0.689 . . . . 0.0 109.825 176.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.409 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 11.1 Cg_endo -63.61 148.74 92.15 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.511 2.141 . . . . 0.0 113.761 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 52.2 m-85 -154.49 -167.37 2.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.971 171.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.1 m -57.12 133.44 55.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 113.496 -1.684 . . . . 0.0 110.499 163.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -25.5 66.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.003 162.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 20.0 m-70 -166.63 162.69 11.41 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.356 169.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -71.28 -13.83 15.24 Favored 'Cis proline' 0 N--CA 1.482 0.831 0 C-N-CA 122.5 -1.875 . . . . 0.0 113.509 -15.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.0 m -59.7 -43.41 94.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.65 -156.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -60.9 -54.43 45.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.494 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -77.72 -16.01 58.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.358 -167.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.258 -177.821 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.442 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 20.9 Cg_exo . . . . . 0 N--CA 1.486 1.034 0 N-CA-C 113.615 0.583 . . . . 0.0 113.615 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.95 160.03 27.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.416 -167.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -85.92 121.11 73.07 Favored Pre-proline 0 C--O 1.251 1.148 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.096 -164.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.579 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -61.25 -28.9 85.52 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 C-N-CA 122.724 2.283 . . . . 0.0 113.163 169.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -70.07 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.426 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.45 -22.13 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.619 -166.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 72.59 54.45 0.15 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.475 -171.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -168.71 1.36 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 159.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 152.88 23.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.583 161.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -112.7 112.32 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.54 -162.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -75.54 159.76 30.91 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.361 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -60.45 -62.42 1.87 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.778 -159.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.58 11.11 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.688 -173.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -101.99 13.75 33.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.505 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -97.04 151.07 20.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.36 -160.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.37 156.2 15.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.736 156.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.93 137.13 52.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.667 -169.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.436 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 42.4 t -174.14 136.82 0.52 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.271 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.99 18.75 7.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.618 -172.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.58 28.37 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.39 155.24 19.31 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 114.89 -0.655 . . . . 0.0 110.184 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.442 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.2 m-20 -88.5 177.19 6.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.323 -166.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 26.6 m95 -149.17 -175.74 5.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.153 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -98.67 145.55 26.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.463 168.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.553 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.74 -44.86 96.46 Favored Pre-proline 0 CA--C 1.545 0.774 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.838 -166.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -64.71 -35.58 45.65 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.532 2.155 . . . . 0.0 113.547 173.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.22 -44.35 84.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.339 -163.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.546 HD12 ' HG3' ' A' ' 49' ' ' PRO . 3.8 tp -60.73 82.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.354 -174.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.57 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 10.7 ttmt -148.58 144.88 27.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.14 -0.937 . . . . 0.0 110.331 -162.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -65.02 126.17 27.2 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.536 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -96.88 27.37 4.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.065 166.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.44 -35.78 2.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.279 -175.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -126.09 -25.98 3.47 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.062 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.58 49.47 6.62 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -175.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.03 124.2 45.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.317 164.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.57 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 95.4 m -61.18 135.09 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.164 167.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.693 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.4 mt -100.58 139.47 36.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.392 -164.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 73.5 m -60.62 154.35 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.184 163.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.6 t -66.29 62.69 0.04 OUTLIER 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.486 160.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 146.95 144.74 4.08 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.371 -162.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.91 13.53 83.55 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 119.853 -1.165 . . . . 0.0 111.483 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.693 ' HB2' HD13 ' A' ' 37' ' ' LEU . 8.7 p80 -112.22 -170.0 1.58 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 114.667 -0.767 . . . . 0.0 110.813 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -152.04 -162.77 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.604 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.592 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.5 tt0 -170.02 138.1 1.68 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.183 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -96.49 173.03 7.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.775 157.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 89.01 0.21 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.083 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.07 -65.95 0.33 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -168.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -152.61 144.78 16.79 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-O 121.521 0.677 . . . . 0.0 109.96 -162.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.592 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.4 Cg_endo -72.73 171.26 17.65 Favored 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.834 2.356 . . . . 0.0 113.62 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 29.5 m-85 -155.94 -164.55 1.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.241 165.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.4 m -57.91 135.68 56.93 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.258 162.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -60.85 -34.52 74.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.054 162.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 25.3 m-70 -157.6 164.25 22.11 Favored Pre-proline 0 CA--C 1.552 1.03 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.335 166.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.47 -15.69 16.93 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.584 -1.84 . . . . 0.0 113.534 -14.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.0 m -59.57 -41.91 91.28 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.826 -156.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.409 ' CD2' ' CB ' ' A' ' 43' ' ' ALA . 9.6 t80 -61.18 -56.94 14.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.452 172.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.53 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.7 t -62.99 -20.51 65.35 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.372 -171.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.184 -166.143 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.402 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 10.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.64 0.592 . . . . 0.0 113.64 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 147.36 41.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.405 -170.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.6 t -85.64 118.94 71.57 Favored Pre-proline 0 C--O 1.25 1.13 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.178 -164.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.574 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.0 Cg_endo -59.49 -27.51 85.14 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 122.518 2.145 . . . . 0.0 113.131 169.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -72.63 -70.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.448 -174.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -96.78 -21.92 17.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.626 -165.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 72.33 53.18 0.17 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.544 -173.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -112.72 -169.06 1.41 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.944 159.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -101.98 151.01 22.63 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.596 163.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 46.8 t -110.55 110.69 33.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.616 -167.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.43 161.67 29.03 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.385 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -60.15 -62.3 1.97 Allowed 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -158.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.14 60.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.731 -175.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -104.39 49.26 0.82 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.861 167.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 143.13 45.85 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.504 -1.225 . . . . 0.0 110.601 170.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 m -132.5 117.93 33.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.442 152.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.1 m -97.75 142.43 29.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.402 -173.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.1 t -177.72 137.27 0.2 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.089 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.843 HD23 ' OE2' ' A' ' 44' ' ' GLU . 4.6 mp 60.27 16.88 6.52 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.431 -1.258 . . . . 0.0 110.603 -172.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.99 -25.63 24.74 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 164.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -117.17 149.67 39.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.807 -0.696 . . . . 0.0 110.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -85.7 177.69 7.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.193 -165.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.574 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.2 m95 -151.49 -176.59 5.65 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.483 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.2 m80 -97.71 150.21 21.45 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.59 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.7 ttt180 -61.3 -48.87 90.14 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.83 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 3.9 Cg_exo -66.85 -26.27 44.75 Favored 'Trans proline' 0 N--CA 1.484 0.931 0 C-N-CA 122.502 2.134 . . . . 0.0 113.569 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.55 -51.97 10.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.228 -164.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.567 HD12 ' CD2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -61.92 91.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.403 -160.844 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.517 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 mtpp -145.76 153.39 40.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.327 -172.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -65.23 122.42 17.07 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.242 163.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -96.0 28.53 3.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.117 169.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -50.42 2.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.074 177.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.9 p -112.26 -20.25 11.93 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.916 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.46 40.12 20.01 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 126.36 41.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.435 -0.383 . . . . 0.0 110.326 167.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.4 m -61.08 137.21 58.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.27 168.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 46.1 mt -99.64 161.24 13.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -164.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -98.73 -163.53 1.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.229 -166.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.567 ' H ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -93.49 20.86 6.78 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.471 -177.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.22 55.34 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.34 12.77 4.34 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 170.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 12.6 p80 -106.73 -168.94 1.48 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.707 -0.747 . . . . 0.0 110.745 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -150.61 -169.97 3.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.991 165.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.843 ' OE2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -132.21 141.24 48.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.124 170.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -139.92 101.54 4.2 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.846 175.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 58.62 46.42 14.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.627 -169.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 63.54 19.36 62.4 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.611 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.92 98.5 42.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 121.199 0.523 . . . . 0.0 109.73 169.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 11.3 Cg_endo -54.94 141.37 78.42 Favored 'Trans proline' 0 N--CA 1.487 1.088 0 C-N-CA 122.055 1.837 . . . . 0.0 113.446 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 97.5 m-85 -150.49 -179.23 7.05 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.106 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.8 m -56.72 131.16 48.34 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.472 165.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.97 -33.64 73.52 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.886 161.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.6 m-70 -155.94 164.83 20.01 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.258 163.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.8 Cg_endo -73.06 -16.82 17.48 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.696 -1.793 . . . . 0.0 113.616 -13.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.7 m -59.59 -43.92 93.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.778 -156.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -61.11 -55.34 33.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.316 177.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 29.6 t -80.94 -16.79 52.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.469 -165.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.309 -178.139 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.419 ' H2 ' ' H ' ' A' ' 2' ' ' LYS . 3.6 Cg_endo . . . . . 0 N--CA 1.484 0.931 0 N-CA-C 113.568 0.564 . . . . 0.0 113.568 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.419 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -138.17 139.95 39.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.443 170.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.1 t -86.07 115.64 62.68 Favored Pre-proline 0 C--O 1.25 1.114 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.258 -164.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.573 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -60.05 -16.79 41.34 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 C-N-CA 122.771 2.314 . . . . 0.0 113.313 170.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -69.21 0.67 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.52 -171.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -94.21 -21.44 19.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.608 -170.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.34 52.1 0.18 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.496 -171.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.06 -168.49 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.856 160.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -106.51 152.08 24.15 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.606 161.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -111.65 111.85 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.653 -164.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.483 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 6.2 t80 -75.46 157.84 33.47 Favored 'General case' 0 N--CA 1.458 -0.054 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.311 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -59.78 -62.1 2.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 -157.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.55 -11.32 60.86 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.671 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.483 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.2 pt-20 -102.73 42.97 1.1 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.17 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.89 149.87 29.25 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.454 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.3 m -141.44 148.63 20.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.627 155.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.55 137.61 50.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.657 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 15.8 t -176.33 128.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.336 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 59.93 35.37 21.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.605 -170.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.82 18.04 52.13 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HG2' ' N ' ' A' ' 22' ' ' ASP . 20.7 ttmt -137.11 153.61 50.48 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 164.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 m-20 -88.68 177.08 6.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.392 -165.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.573 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 23.4 m95 -151.15 -173.25 4.44 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.954 -177.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -102.94 146.03 28.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 113.894 -1.503 . . . . 0.0 110.54 169.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.6 OUTLIER -60.91 -50.13 86.23 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.862 -169.204 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 6.5 Cg_exo -62.42 -34.8 75.44 Favored 'Trans proline' 0 N--CA 1.484 0.933 0 C-N-CA 122.549 2.166 . . . . 0.0 113.49 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.77 -52.9 58.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.232 -167.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.733 HD23 ' O ' ' A' ' 37' ' ' LEU . 2.1 tp -60.42 93.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.253 -164.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.543 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.1 mttp -148.15 139.1 23.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.356 -164.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.2 t -65.66 120.81 13.63 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.354 166.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 5.7 pt-20 -98.69 39.74 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.755 167.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HD2' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -132.18 -39.32 1.06 Allowed 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.288 179.238 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -119.89 -22.2 6.87 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.12 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.99 41.44 12.32 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -95.19 122.55 37.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.49 -0.355 . . . . 0.0 110.372 167.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 90.8 m -61.09 135.62 57.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.317 170.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.733 ' O ' HD23 ' A' ' 28' ' ' LEU . 87.1 mt -101.7 97.83 8.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.314 -167.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.4 t -60.05 -160.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.352 161.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -68.94 0.2 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.611 170.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.91 -161.99 9.8 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 154.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.53 69.16 0.36 Allowed Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 165.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.683 ' NE2' HD21 ' A' ' 28' ' ' LEU . 24.0 p80 -90.77 -170.83 2.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.912 -0.644 . . . . 0.0 110.951 169.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.422 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -165.28 -168.9 1.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.196 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.9 pp20? -152.88 139.7 19.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.057 -169.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -137.25 106.61 6.08 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.856 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.38 33.19 22.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.906 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.46 -27.57 10.48 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 166.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 103.01 20.55 Favored Pre-proline 0 C--O 1.244 0.771 0 CA-C-O 121.328 0.585 . . . . 0.0 109.845 -170.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.57 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.7 Cg_endo -63.75 147.81 92.33 Favored 'Trans proline' 0 N--CA 1.484 0.923 0 C-N-CA 122.485 2.123 . . . . 0.0 113.669 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 4.3 m-85 -139.89 -165.27 1.86 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.78 164.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.9 m -57.56 135.11 56.63 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.099 159.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.433 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 13.6 t-20 -62.81 -33.0 74.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.927 161.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.443 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 21.6 m-70 -157.29 162.41 27.5 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.408 169.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -71.54 -14.9 15.59 Favored 'Cis proline' 0 N--CA 1.482 0.826 0 C-N-CA 122.548 -1.855 . . . . 0.0 113.477 -14.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.3 m -59.84 -45.95 90.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.691 -156.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -60.84 -53.61 55.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.454 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.443 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.5 p -66.96 -28.71 68.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.334 -170.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.302 -169.53 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.604 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 2.4 Cg_endo . . . . . 0 N--CA 1.487 1.106 0 N-CA-C 113.457 0.522 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.23 139.0 52.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.471 170.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.4 t -85.77 116.63 66.42 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.144 -165.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.616 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -60.33 -23.55 74.86 Favored 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 122.723 2.282 . . . . 0.0 113.283 169.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -70.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.466 -174.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -94.91 -22.08 18.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.658 -167.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.48 57.58 0.14 Allowed 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.521 -171.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -117.19 -168.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.919 160.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -104.42 153.61 20.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.688 162.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.913 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -113.04 114.21 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.537 -163.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -71.99 156.38 39.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.396 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -60.51 -62.26 1.99 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.837 -159.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.37 -1.17 9.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.688 -173.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.82 14.81 31.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.432 178.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.31 152.05 19.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.286 -161.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.491 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.73 150.12 16.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.646 155.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 m -113.58 135.14 54.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.803 -168.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.7 t -177.69 139.62 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.422 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.09 30.24 19.73 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.629 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.42 18.49 79.38 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 166.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -152.79 164.7 37.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.448 -0.376 . . . . 0.0 110.163 166.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 3.8 m-20 -90.65 176.79 6.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.392 -166.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.616 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.9 m95 -147.45 -176.71 5.35 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.166 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.913 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.3 m80 -101.36 142.62 32.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.499 168.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.72 -45.37 96.95 Favored Pre-proline 0 CA--C 1.543 0.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.819 -168.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 6.6 Cg_endo -62.96 -34.03 72.56 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.513 2.142 . . . . 0.0 113.647 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -67.48 -56.02 11.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.279 -166.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.769 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.1 tp -60.59 89.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.391 -164.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.54 146.32 29.4 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.418 -174.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.3 t -60.12 124.71 21.09 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.354 170.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 50' ' ' TYR . 1.3 tm-20 -96.34 20.1 10.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.133 169.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -105.32 -60.24 1.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.317 166.366 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.6 p -105.81 -21.54 13.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.825 -168.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.5 39.85 20.72 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.38 121.41 37.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.903 0.382 . . . . 0.0 110.194 166.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.99 132.51 54.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.288 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.596 HD13 ' HB2' ' A' ' 42' ' ' HIS . 60.7 mt -96.8 123.2 40.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.314 -168.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.532 HG23 ' N ' ' A' ' 40' ' ' GLY . 4.7 t -60.11 -162.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.544 168.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -95.65 32.49 1.81 Allowed 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.522 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.532 ' N ' HG23 ' A' ' 38' ' ' THR . . . -168.0 143.83 8.45 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -170.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.85 13.84 83.2 Favored Glycine 0 N--CA 1.468 0.787 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.284 163.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.769 ' CE1' HD11 ' A' ' 28' ' ' LEU . 10.1 p80 -106.1 -168.72 1.47 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.581 -0.81 . . . . 0.0 110.713 169.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.453 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -157.67 -177.4 6.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.244 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -168.8 124.6 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.881 -166.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -155.39 121.46 5.14 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.694 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.47 39.51 25.0 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.796 -176.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 -21.39 37.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm -98.18 102.81 15.05 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 121.826 0.822 . . . . 0.0 109.845 -168.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.549 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 13.5 Cg_endo -59.34 147.87 89.08 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.022 1.814 . . . . 0.0 113.372 168.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 9.8 m-85 -154.92 -166.75 2.39 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.241 169.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.2 m -57.63 135.37 56.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.372 163.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -60.62 -30.92 70.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.144 162.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.526 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 30.5 m-70 -162.63 164.9 16.06 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.369 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.447 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -71.68 -14.34 15.9 Favored 'Cis proline' 0 N--CA 1.482 0.82 0 C-N-CA 122.517 -1.868 . . . . 0.0 113.586 -14.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.1 m -59.85 -42.3 93.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -156.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.09 -39.58 90.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.376 176.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.526 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 24.7 p -76.12 -18.09 59.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.206 -168.364 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.45 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 1.5 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -134.67 156.7 48.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.424 170.835 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.8 t -81.39 119.26 75.21 Favored Pre-proline 0 C--O 1.25 1.111 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.346 -161.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.19 -19.03 61.85 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 C-N-CA 122.878 2.385 . . . . 0.0 113.233 167.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.67 -77.26 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.47 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -91.5 -19.56 22.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.903 -164.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.23 55.03 0.17 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.495 -173.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -114.74 -168.64 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.995 160.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 7.7 mt-10 -104.77 153.24 21.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.546 161.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.911 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -113.21 113.27 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.492 -163.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.38 157.15 37.48 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.42 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.39 -62.38 1.9 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 -159.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.54 -1.07 9.85 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.553 -173.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -102.81 14.21 32.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.442 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.52 152.52 18.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.266 -161.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.648 HG21 HD22 ' A' ' 28' ' ' LEU . 16.3 m -145.04 147.67 18.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.578 155.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.51 137.06 52.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.675 -168.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 10.5 t -178.08 130.01 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.297 -171.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.14 28.51 18.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.538 -171.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.01 18.05 70.38 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -138.68 155.1 48.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 164.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.45 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -88.9 177.03 6.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.375 -165.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.3 m95 -150.56 -176.74 5.61 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.102 -177.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.911 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -100.57 142.38 32.11 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.448 169.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.447 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 5.8 mtm180 -61.08 -46.31 96.24 Favored Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.781 -170.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 7.9 Cg_exo -60.84 -36.1 85.45 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.608 2.205 . . . . 0.0 113.535 174.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.44 -46.89 74.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.343 -168.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.802 HD11 ' CE1' ' A' ' 42' ' ' HIS . 7.6 tp -62.88 93.07 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.441 -166.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.49 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -149.31 142.48 25.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -60.01 124.42 20.15 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.551 174.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.35 23.88 5.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.215 171.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -59.52 2.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.378 168.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.4 p -104.0 -16.15 15.4 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.863 -169.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 48.97 58.02 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -171.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -104.57 115.23 29.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.453 -0.373 . . . . 0.0 110.323 167.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.9 m -61.26 134.94 57.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.881 HD13 ' HB2' ' A' ' 42' ' ' HIS . 75.8 mt -97.46 125.81 42.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.425 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -71.6 -162.45 0.08 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.481 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.21 -15.29 32.78 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.605 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.642 ' H ' HG23 ' A' ' 38' ' ' THR . . . -159.25 -179.62 34.21 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -169.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.82 15.42 81.33 Favored Glycine 0 C--N 1.342 0.872 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.337 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.881 ' HB2' HD13 ' A' ' 37' ' ' LEU . 7.0 p80 -109.71 -168.47 1.33 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 114.521 -0.84 . . . . 0.0 110.579 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -159.12 -169.11 2.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.332 170.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.487 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -150.77 131.69 14.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.989 -168.388 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 39.9 t60 -135.62 100.45 4.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.994 176.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 58.6 43.89 18.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.832 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.09 -21.53 44.68 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -97.89 100.94 9.48 Favored Pre-proline 0 C--O 1.242 0.686 0 CA-C-O 121.283 0.563 . . . . 0.0 109.807 -172.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 10.4 Cg_endo -62.31 164.99 16.03 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.378 2.052 . . . . 0.0 113.737 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 71.9 m-85 -161.99 176.61 10.59 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.073 -171.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.8 m -57.86 128.41 36.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.961 -1.472 . . . . 0.0 110.054 160.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -60.86 -32.93 72.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.912 162.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 7.2 m-70 -154.26 161.4 29.38 Favored Pre-proline 0 CA--C 1.551 1.018 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.154 163.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -74.39 -18.25 18.21 Favored 'Cis proline' 0 C--N 1.354 0.835 0 C-N-CA 122.718 -1.784 . . . . 0.0 113.61 -12.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -58.92 -45.34 90.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.89 -154.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -61.05 -61.89 2.25 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.0 p -72.68 -11.91 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.444 -173.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.374 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.068 179.182 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.487 1.092 0 N-CA-C 113.542 0.555 . . . . 0.0 113.542 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 6.4 pttp -126.12 156.21 40.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.36 -168.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -85.28 116.97 67.76 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.126 -163.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.611 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_endo -60.16 -21.85 67.74 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.584 2.189 . . . . 0.0 113.108 169.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -72.47 0.38 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.484 -173.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.6 p -91.84 -21.16 20.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.598 -169.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.02 52.29 0.13 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.597 -171.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -108.61 -169.33 1.48 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.884 158.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.497 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -106.76 151.72 24.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.531 160.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.7 t -112.68 124.91 69.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.711 -166.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.537 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 13.1 p90 -101.29 160.31 14.52 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.488 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HA ' ' HB3' ' A' ' 15' ' ' ARG . 7.0 p90 -59.61 -40.96 89.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.89 -158.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.479 ' H ' ' HD1' ' A' ' 11' ' ' TYR . . . -81.06 -0.09 38.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.161 -163.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 0.7 OUTLIER -113.37 9.74 18.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.686 166.203 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.433 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -80.66 141.15 35.22 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.36 -159.116 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.2 m -146.82 125.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.024 160.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -98.79 142.03 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.434 -168.556 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.5 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.6 138.65 0.22 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.566 -168.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' N ' HD22 ' A' ' 19' ' ' LEU . 3.2 mm? 59.92 32.49 21.21 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.726 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.41 -24.09 21.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 168.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.4 ' CE ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.35 -174.01 2.52 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 114.864 -0.668 . . . . 0.0 110.022 177.089 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.2 m-20 -106.4 177.05 4.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.309 -173.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.611 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 37.4 m95 -149.71 -172.29 4.11 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.267 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.5 m80 -101.65 159.44 15.31 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.558 170.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -74.3 -57.05 2.31 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.717 -175.522 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.448 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 4.2 Cg_exo -49.44 -22.47 6.16 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 C-N-CA 122.282 1.988 . . . . 0.0 113.411 172.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -87.0 -58.17 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.267 -167.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.92 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -62.81 83.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.348 -173.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.5 mtmt -156.67 139.55 15.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.266 -164.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -63.12 123.47 18.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.432 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 8.0 pt-20 -97.93 27.67 4.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.819 164.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.15 -50.76 2.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.351 170.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.99 -21.23 10.16 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.955 -175.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.45 43.02 16.69 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -99.81 122.42 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.343 168.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.0 m -60.84 137.19 58.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.32 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.821 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.6 mt -101.15 148.64 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.442 -162.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.504 HG22 ' N ' ' A' ' 39' ' ' SER . 97.5 m -102.73 168.81 9.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.369 -171.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.504 ' N ' HG22 ' A' ' 38' ' ' THR . 0.1 OUTLIER -62.87 78.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.57 179.517 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.43 58.49 0.96 Allowed Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.33 9.61 1.71 Allowed Glycine 0 C--N 1.334 0.458 0 CA-C-N 114.435 -0.882 . . . . 0.0 111.996 168.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.92 ' CE1' HD11 ' A' ' 28' ' ' LEU . 6.1 p80 -112.12 -171.31 1.82 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.983 0.42 . . . . 0.0 110.555 -170.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -141.64 -164.72 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.612 166.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.478 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.75 146.74 2.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.218 162.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.521 ' NE2' ' HB2' ' A' ' 48' ' ' LYS . 34.2 p80 -86.96 -165.76 1.38 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.548 155.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.17 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.285 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.66 39.1 41.61 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 172.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.521 ' HB2' ' NE2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -158.34 108.39 1.69 Allowed Pre-proline 0 CA--C 1.544 0.738 0 CA-C-O 121.315 0.579 . . . . 0.0 109.804 166.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 11.8 Cg_endo -71.46 154.14 60.59 Favored 'Trans proline' 0 N--CA 1.483 0.878 0 C-N-CA 122.963 2.442 . . . . 0.0 113.71 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 8.4 m-85 -147.14 -164.73 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.908 164.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.8 m -57.49 138.13 55.47 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.261 161.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -60.66 -30.66 70.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.172 163.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.538 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 27.9 m-70 -164.37 164.84 13.57 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.355 168.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 12.2 Cg_endo -70.91 -12.96 14.6 Favored 'Cis proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.447 -1.897 . . . . 0.0 113.556 -15.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 68.9 m -59.72 -42.55 93.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.711 -157.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CD2' ' CB ' ' A' ' 43' ' ' ALA . 23.0 t80 -60.87 -45.07 95.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.507 176.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.538 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 25.3 t -76.2 -25.16 54.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.527 -172.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.286 -174.591 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.486 1.065 0 N-CA-C 113.453 0.52 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.97 144.19 33.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.408 169.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.5 t -83.18 117.63 69.19 Favored Pre-proline 0 C--O 1.248 1.025 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.17 -162.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -60.46 -22.14 70.59 Favored 'Trans proline' 0 N--CA 1.489 1.227 0 C-N-CA 122.749 2.299 . . . . 0.0 113.222 169.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -73.25 0.31 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.396 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -94.44 -20.87 19.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.692 -165.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 t0 72.57 57.09 0.14 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.547 -172.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.95 -168.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.02 159.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.6 152.97 21.79 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.573 161.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -112.14 112.05 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.472 -163.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -75.75 159.51 30.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.382 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.34 -62.55 1.78 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.866 -159.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.48 -1.88 12.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.645 -173.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -101.86 14.08 32.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.478 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -98.74 146.31 26.02 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.374 -160.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.963 HG21 HD22 ' A' ' 28' ' ' LEU . 12.1 m -141.92 126.74 17.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.248 152.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 82.8 m -95.57 132.38 40.76 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.401 -175.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.475 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.3 OUTLIER -162.65 122.58 2.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.224 -159.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.684 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.05 23.77 12.98 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.67 -176.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.73 17.06 66.63 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.696 -0.961 . . . . 0.0 110.696 164.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -151.21 150.38 30.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 162.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.2 178.29 8.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.252 -160.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.9 m95 -152.2 -177.32 6.11 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.237 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.9 m80 -101.09 143.63 30.98 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.053 -1.431 . . . . 0.0 110.526 170.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.4 ttp180 -61.18 -46.48 95.82 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.78 -173.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -58.88 -27.64 84.97 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.647 2.231 . . . . 0.0 113.585 174.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -81.04 -46.96 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.963 HD22 HG21 ' A' ' 16' ' ' VAL . 8.0 tp -60.78 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.442 -173.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 13.1 mtmt -135.9 127.48 28.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.409 -164.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -61.35 125.88 25.37 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.353 167.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.0 tp10 -95.65 30.4 2.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.123 168.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.98 -43.03 1.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.173 -177.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.3 p -120.09 -9.32 9.62 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.815 -1.084 . . . . 0.0 111.212 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.82 37.9 95.36 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -95.0 121.47 36.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.28 172.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.2 m -61.31 135.97 57.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.17 166.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 42' ' ' HIS . 27.3 mt -102.11 123.45 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.378 -165.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -84.38 -175.65 5.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.498 169.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.4 p -61.06 -9.85 5.15 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.506 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.81 ' H ' HG23 ' A' ' 38' ' ' THR . . . -63.51 -170.04 1.5 Allowed Glycine 0 CA--C 1.532 1.094 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.736 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.19 76.52 2.13 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -158.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.889 ' CE1' HD21 ' A' ' 28' ' ' LEU . 20.3 p80 -98.61 -167.02 1.43 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.264 -0.968 . . . . 0.0 110.572 169.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.58 -166.67 1.54 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.799 -169.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.53 154.26 3.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.167 164.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.54 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 15.0 p80 -92.21 -167.66 1.81 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.533 156.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.98 91.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.173 -176.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.67 53.87 9.28 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 178.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 6.1 ttmm -179.78 106.96 0.19 Allowed Pre-proline 0 CA--C 1.541 0.613 0 CA-C-O 121.764 0.792 . . . . 0.0 110.021 165.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.8 Cg_endo -71.21 148.82 56.6 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.744 2.296 . . . . 0.0 113.665 173.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.7 m-85 -144.1 -171.91 3.66 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.767 162.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 79.5 m -58.2 137.7 56.83 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.156 165.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -67.88 -34.37 76.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.58 -1.191 . . . . 0.0 109.993 163.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.436 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.8 m-70 -150.36 167.68 12.52 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.406 165.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.29 -20.39 6.64 Favored 'Cis proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.818 -2.159 . . . . 0.0 112.628 -21.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.6 m -57.31 -48.13 79.73 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.235 -153.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -61.07 -55.46 32.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.409 174.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.436 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.9 t -60.82 -17.74 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.564 -174.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.193 -168.206 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.086 0 N-CA-C 113.478 0.53 . . . . 0.0 113.478 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -145.13 136.89 25.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.277 -170.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 32.0 t -85.11 119.92 72.97 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.043 -162.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -63.25 -19.6 68.81 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 C-N-CA 122.971 2.447 . . . . 0.0 113.375 171.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.498 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 0.2 OUTLIER -85.05 -64.47 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.473 -171.053 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.5 p -96.48 -23.76 16.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.684 -170.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 72.21 64.55 0.13 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.512 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.5 OUTLIER -127.38 -170.81 2.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.105 162.019 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -99.66 150.48 22.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.306 163.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.928 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.9 t -112.58 113.64 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.505 -163.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -68.43 150.79 47.7 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.461 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.35 -62.82 1.59 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.834 -159.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -1.88 11.55 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.603 -174.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -101.85 13.2 35.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.302 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -96.44 155.8 16.61 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.249 -161.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.95 HG21 HD22 ' A' ' 28' ' ' LEU . 15.5 m -144.49 145.16 21.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.423 155.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -114.69 137.59 51.73 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.652 -168.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.476 ' C ' HD22 ' A' ' 19' ' ' LEU . 8.7 t -177.69 128.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.334 -169.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.658 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.06 28.63 18.2 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.588 -172.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.38 17.5 72.51 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 167.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mmtt -137.22 153.19 50.45 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 163.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.41 176.77 7.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.399 -167.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.572 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 33.9 m95 -148.38 175.53 11.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 114.231 -1.35 . . . . 0.0 109.411 -177.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.928 ' CD2' HG22 ' A' ' 10' ' ' VAL . 40.5 m80 -96.81 138.97 33.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.392 167.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.7 tpp180 -60.94 -47.06 96.63 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.861 -165.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -62.23 -35.24 75.42 Favored 'Trans proline' 0 N--CA 1.484 0.914 0 C-N-CA 122.53 2.153 . . . . 0.0 113.666 174.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.498 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.3 m -61.21 -41.32 96.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.173 -171.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.981 HD11 ' CE1' ' A' ' 42' ' ' HIS . 10.2 tp -67.79 103.35 1.41 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -164.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -146.92 157.08 43.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.31 -178.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.1 t -72.18 127.42 32.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.367 171.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -95.83 35.87 1.35 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 114.078 -1.419 . . . . 0.0 110.168 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.502 ' HB2' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -138.08 -46.47 0.52 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.283 -176.258 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -115.87 -18.78 10.67 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.124 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.29 38.85 28.2 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -108.0 136.9 46.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.007 -0.597 . . . . 0.0 110.565 173.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -61.68 150.3 36.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.325 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.616 HD13 ' CB ' ' A' ' 42' ' ' HIS . 42.6 mt -113.28 154.9 26.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.398 -167.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -88.21 -170.57 3.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.396 -175.214 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.629 ' H ' HG22 ' A' ' 38' ' ' THR . 16.3 t -61.65 -42.37 98.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.416 -176.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.58 59.5 0.42 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -128.21 13.45 6.31 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 111.63 -0.588 . . . . 0.0 111.63 173.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.981 ' CE1' HD11 ' A' ' 28' ' ' LEU . 8.6 p80 -114.04 -167.65 1.24 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.031 -0.584 . . . . 0.0 110.481 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -174.11 159.1 3.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.044 165.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.8 pp20? -110.3 134.96 51.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.074 -163.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -128.11 99.09 5.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.229 -1.35 . . . . 0.0 109.878 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 58.47 41.58 22.48 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.747 -173.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.435 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.18 -22.61 38.81 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 168.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -92.36 102.27 6.26 Favored Pre-proline 0 C--O 1.243 0.742 0 CA-C-O 121.253 0.549 . . . . 0.0 109.812 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 8.1 Cg_endo -58.61 167.91 4.65 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.482 2.121 . . . . 0.0 113.468 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 32.1 m-85 -164.46 170.17 16.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.892 -167.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -57.3 133.98 55.58 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 113.85 -1.523 . . . . 0.0 110.269 160.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -27.99 68.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.07 164.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.2 m-70 -163.8 163.79 15.55 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.354 165.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -72.36 -13.53 17.32 Favored 'Cis proline' 0 N--CA 1.482 0.824 0 C-N-CA 122.645 -1.815 . . . . 0.0 113.578 -13.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.656 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 76.2 m -59.83 -46.34 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -157.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.13 -47.91 80.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.339 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.26 -14.14 61.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.298 178.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . . . . . . 0 CA--C 1.534 0.328 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.183 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.488 ' HD3' ' NZ ' ' A' ' 21' ' ' LYS . 10.2 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.54 0.554 . . . . 0.0 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.429 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -118.86 159.2 24.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.423 -168.828 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.8 t -81.94 118.72 73.12 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.391 -162.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -59.24 -19.38 49.78 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.766 2.311 . . . . 0.0 113.252 167.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.562 ' HE3' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -83.36 -77.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.431 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.24 -18.8 22.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.035 -162.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 t70 71.88 51.92 0.22 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.485 -175.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -168.6 1.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.008 161.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' HG2' ' CD ' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.71 153.07 21.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.657 162.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.7 t -112.39 112.95 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.581 -163.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -70.66 154.98 41.33 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.29 177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -60.68 -62.29 1.97 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.796 -160.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.48 10.82 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.614 -173.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -102.46 14.52 31.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.475 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ptt-85 -96.42 155.13 16.89 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.214 -161.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.811 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -147.31 151.73 13.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.812 157.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.58 137.84 47.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.664 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.8 t -176.02 137.58 0.32 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.143 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.578 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 59.97 18.97 8.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.574 -171.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.45 28.93 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.488 ' NZ ' ' HD3' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -107.0 157.64 17.64 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.943 -0.629 . . . . 0.0 110.269 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.26 176.83 7.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.382 -166.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.8 m95 -149.54 -176.08 5.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.105 -177.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.0 m80 -100.36 138.61 37.19 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.91 -1.495 . . . . 0.0 110.543 169.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.465 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.3 ttp-105 -61.17 -47.6 94.23 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.803 -175.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.2 Cg_exo -52.44 -33.5 57.3 Favored 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 122.584 2.189 . . . . 0.0 113.6 170.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -77.63 -55.53 5.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.252 -170.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.811 HD22 HG21 ' A' ' 16' ' ' VAL . 3.0 tp -61.48 78.26 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.381 -175.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 ptpt -137.31 155.44 49.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.416 170.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -59.51 125.88 25.38 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.651 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -93.53 22.67 5.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.226 170.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.485 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.08 -60.11 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.33 166.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.4 p -106.32 -21.22 13.16 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.902 -167.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.84 40.98 20.12 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 124.06 33.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.445 -0.377 . . . . 0.0 110.26 165.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 36.6 m -61.56 135.84 57.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.133 166.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 95.9 mt -102.97 110.16 21.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.388 -161.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 39' ' ' SER . 4.9 t -98.86 -167.06 1.43 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.44 171.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.657 ' HB3' HG23 ' A' ' 38' ' ' THR . 24.9 p 58.79 -162.73 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.564 158.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -122.36 47.74 1.0 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 157.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -103.14 15.31 54.92 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.43 ' HE1' ' OG ' ' A' ' 18' ' ' SER . 27.2 p80 -104.6 -170.48 1.77 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.473 0.654 . . . . 0.0 111.055 176.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.48 -166.05 2.37 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.161 175.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -170.87 164.91 7.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.885 164.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.536 ' NE2' ' HG2' ' A' ' 48' ' ' LYS . 31.8 p80 -111.05 106.14 15.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.715 163.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.15 14.85 2.95 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.006 165.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.539 ' HA2' ' HB2' ' A' ' 4' ' ' PRO . . . 126.99 16.28 2.43 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.562 ' HD3' ' HE3' ' A' ' 5' ' ' LYS . 9.4 tppt? -129.66 86.49 55.38 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -173.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.566 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.4 Cg_endo -71.29 155.56 60.33 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.665 2.243 . . . . 0.0 113.721 -168.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.7 m-85 -152.99 -164.12 1.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.813 167.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.1 m -58.18 137.34 57.1 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.103 159.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -61.32 -31.58 71.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.964 162.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.447 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.2 m-70 -161.53 164.56 18.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.34 170.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.415 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.9 Cg_endo -70.31 -11.7 13.06 Favored 'Cis proline' 0 N--CA 1.483 0.906 0 C-N-CA 122.465 -1.89 . . . . 0.0 113.365 -15.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.5 m -61.99 -45.38 93.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.685 -157.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -61.03 -47.49 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.425 176.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.05 -15.07 62.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.543 -176.009 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.209 -173.162 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 113.538 0.553 . . . . 0.0 113.538 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 3.1 pttt -119.76 154.88 33.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.355 -167.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.2 t -78.44 117.64 67.52 Favored Pre-proline 0 C--O 1.248 0.974 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.637 -164.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -62.7 -6.88 9.8 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 123.031 2.487 . . . . 0.0 113.397 168.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.556 ' CE ' ' HD2' ' A' ' 49' ' ' PRO . 10.8 tptp -97.69 -75.87 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.346 -178.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -89.89 -12.35 39.21 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.536 -168.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 p30 59.98 53.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.624 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 -168.55 1.44 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.78 157.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -110.17 155.4 22.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.518 0.675 . . . . 0.0 109.626 159.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 26.4 t -112.94 114.08 45.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.476 -157.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.04 156.0 39.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.376 177.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 15' ' ' ARG . 9.9 t80 -60.57 -59.4 5.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 -158.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.44 -0.77 13.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.571 -171.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -102.96 11.94 36.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.585 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.472 ' HD3' ' CD1' ' A' ' 12' ' ' PHE . 2.2 ptm180 -93.55 151.81 19.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.361 -160.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.982 HG21 HD22 ' A' ' 28' ' ' LEU . 15.9 m -145.75 145.58 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.494 155.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.22 135.45 54.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.635 -167.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.8 t -178.49 134.13 0.14 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.182 -168.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.55 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.2 mm? 59.96 18.62 7.71 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.656 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.23 -24.66 30.39 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 167.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mmpm? -110.1 159.18 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 114.815 -0.693 . . . . 0.0 110.107 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.93 176.5 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.289 -166.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.3 m95 -148.29 -179.97 7.33 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.184 -1.371 . . . . 0.0 109.106 -177.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -99.78 141.42 32.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.542 166.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.611 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.55 -49.44 86.96 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.177 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.611 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -59.13 -30.4 93.07 Favored 'Trans proline' 0 N--CA 1.484 0.929 0 C-N-CA 122.456 2.104 . . . . 0.0 113.74 176.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.9 -45.35 67.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.277 -175.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 HG21 ' A' ' 16' ' ' VAL . 9.8 tp -64.91 84.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.325 -167.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -136.82 141.0 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.49 -169.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -67.78 124.12 22.44 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.445 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.85 42.72 1.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.237 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.52 -37.46 0.46 Allowed 'General case' 0 C--O 1.231 0.097 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.701 -178.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -117.52 -31.06 5.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.041 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.13 51.51 4.41 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -173.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.2 126.93 52.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.901 0.381 . . . . 0.0 110.116 164.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.4 m -61.25 133.57 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.228 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.538 HD13 ' HB2' ' A' ' 42' ' ' HIS . 92.1 mt -94.08 143.93 25.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.421 -163.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.874 HG22 ' H ' ' A' ' 40' ' ' GLY . 95.0 m -62.56 155.84 24.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.832 161.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.476 ' OG ' HG12 ' A' ' 16' ' ' VAL . 71.1 m -60.55 -21.07 62.14 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.083 178.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.874 ' H ' HG22 ' A' ' 38' ' ' THR . . . -121.76 179.69 16.19 Favored Glycine 0 CA--C 1.527 0.836 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.537 162.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.25 13.93 82.77 Favored Glycine 0 C--N 1.342 0.878 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.174 172.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.571 ' CE1' HD11 ' A' ' 28' ' ' LEU . 12.7 p80 -110.64 -167.33 1.17 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 113.967 -1.116 . . . . 0.0 110.468 169.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.51 160.36 7.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.151 159.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.55 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -114.88 122.46 46.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.213 -164.321 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.552 ' HB2' ' HG3' ' A' ' 48' ' ' LYS . 1.7 m80 -75.99 -168.25 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.877 160.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.39 85.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.027 -170.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.29 54.41 37.48 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.552 ' HG3' ' HB2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -168.04 105.52 0.56 Allowed Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.706 0.765 . . . . 0.0 109.935 170.35 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.556 ' HD2' ' CE ' ' A' ' 5' ' ' LYS . 14.0 Cg_endo -65.46 146.16 84.49 Favored 'Trans proline' 0 N--CA 1.484 0.92 0 C-N-CA 122.824 2.349 . . . . 0.0 113.624 169.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 22.4 m-85 -143.65 -166.05 2.24 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.843 168.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 94.5 m -57.49 129.71 43.03 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.748 -1.569 . . . . 0.0 110.278 165.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 23.0 t30 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.813 159.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.34 163.24 25.25 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.268 164.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.481 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -72.99 -19.13 15.7 Favored 'Cis proline' 0 C--N 1.352 0.746 0 C-N-CA 122.708 -1.788 . . . . 0.0 113.712 -11.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.1 m -59.1 -45.63 90.39 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.812 -155.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -61.17 -48.63 80.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.427 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -98.67 23.76 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.738 -172.002 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.234 174.121 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.403 ' HD2' ' OD1' ' A' ' 22' ' ' ASP . 23.2 Cg_exo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 113.589 0.573 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.47 159.21 26.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.545 -166.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.0 t -88.04 118.78 70.03 Favored Pre-proline 0 C--O 1.25 1.131 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.221 -162.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -58.81 -23.76 68.53 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.788 2.325 . . . . 0.0 113.14 169.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.79 -73.99 0.28 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.421 -176.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -94.42 -22.05 18.54 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.632 -164.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 71.93 61.6 0.14 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.556 -169.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.71 -167.76 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.058 162.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -103.36 147.66 26.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.299 163.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 49.1 t -109.46 111.97 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.68 -166.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.01 160.77 30.12 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.392 177.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.57 -63.02 1.44 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.75 -160.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.26 -11.0 60.59 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.71 -174.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.22 40.58 1.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.284 172.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.2 149.72 28.97 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.47 -176.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.496 HG21 HD22 ' A' ' 28' ' ' LEU . 18.3 m -143.47 145.71 22.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.475 155.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -113.81 139.5 49.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.546 -166.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.522 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 36.8 t -178.1 131.66 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.314 -171.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.621 HD21 ' OE1' ' A' ' 44' ' ' GLU . 3.1 mm? 59.99 18.82 7.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.551 -171.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.77 -24.47 26.04 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -105.33 157.72 17.13 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.808 -0.696 . . . . 0.0 110.026 179.262 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.403 ' OD1' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -92.16 177.47 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.299 -163.565 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.5 m95 -151.87 -175.13 5.1 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.067 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -101.16 144.83 29.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.474 169.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 34.6 tpt85 -61.62 -48.84 89.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.714 -170.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.4 Cg_endo -59.98 -31.71 93.96 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.597 2.198 . . . . 0.0 113.634 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -71.61 -44.99 63.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.278 -167.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.651 HD12 ' HG3' ' A' ' 49' ' ' PRO . 6.9 tp -66.48 77.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.441 -167.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -133.73 146.76 51.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.283 -173.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.9 t -60.19 128.81 38.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.403 169.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.501 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.2 mm-40 -99.85 26.13 6.61 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.129 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.82 -60.33 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.351 164.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.6 p -99.99 -20.41 16.1 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.766 -170.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.79 42.91 24.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.4 mmtt -119.04 130.01 55.41 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.988 -0.606 . . . . 0.0 110.373 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 m -61.43 149.85 37.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.449 -173.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.554 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 64.9 mt -110.63 125.59 53.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.378 -166.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -83.54 -166.84 1.49 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.705 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t -95.31 35.59 1.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 -165.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.49 58.44 0.01 OUTLIER Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 160.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -139.24 11.21 3.29 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 114.672 -0.764 . . . . 0.0 111.838 163.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.522 ' HE1' ' OG ' ' A' ' 18' ' ' SER . 26.9 p80 -113.46 -169.54 1.52 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.201 -0.5 . . . . 0.0 110.982 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.75 -166.86 2.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.816 -1.083 . . . . 0.0 110.05 168.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.621 ' OE1' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.38 134.83 33.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.168 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.453 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.4 t60 -114.46 162.52 16.57 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 161.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.453 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 50.5 mm-40 -60.06 90.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.332 -160.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.47 25.71 6.85 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 174.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.542 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 176.45 140.43 0.22 Allowed Pre-proline 0 C--O 1.242 0.705 0 CA-C-O 121.264 0.554 . . . . 0.0 109.778 161.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.651 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.6 Cg_endo -66.96 161.0 44.43 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 123.038 2.492 . . . . 0.0 113.609 164.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.542 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 65.0 m-85 -150.4 -173.88 4.59 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.881 168.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.8 m -58.12 132.52 53.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 113.789 -1.55 . . . . 0.0 110.159 161.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.442 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 14.0 t-20 -61.12 -33.2 73.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.882 164.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.479 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 31.7 m-70 -158.35 162.89 25.97 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.318 163.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.28 -18.18 16.81 Favored 'Cis proline' 0 C--N 1.353 0.81 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.646 -11.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 82.7 m -59.24 -43.14 92.41 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.907 -154.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.98 -61.31 2.67 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.376 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.479 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.19 -35.67 81.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.456 -174.001 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.185 -167.251 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo . . . . . 0 N--CA 1.483 0.904 0 N-CA-C 113.595 0.575 . . . . 0.0 113.595 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.08 147.85 51.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.477 171.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -85.13 121.25 74.04 Favored Pre-proline 0 C--O 1.25 1.126 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.044 -166.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.595 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.22 -33.27 90.56 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 122.888 2.392 . . . . 0.0 113.097 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -63.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.42 -168.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -97.78 -24.17 15.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.749 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 72.6 57.33 0.13 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.519 -171.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.32 -168.75 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.972 160.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -104.35 153.69 20.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.637 161.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.4 t -112.94 112.03 38.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.546 -163.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.487 ' CZ ' ' CE1' ' A' ' 12' ' ' PHE . 14.2 t80 -73.14 155.17 39.93 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.181 177.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.2 -59.44 5.41 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -158.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 -0.43 12.94 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.506 -172.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -105.81 17.81 23.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.353 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -96.3 152.09 18.91 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.249 -163.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.463 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.92 145.35 21.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.59 156.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -115.38 137.11 52.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.517 -165.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 t -178.46 128.04 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.247 -170.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.84 36.02 21.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.627 -171.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.12 17.9 53.39 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 168.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.69 156.49 47.36 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 164.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.18 176.69 6.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.319 -165.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.595 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.6 m95 -149.63 -176.84 5.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.12 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -99.93 146.5 26.6 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 113.954 -1.475 . . . . 0.0 110.585 168.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -61.02 -48.35 92.73 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.774 -168.234 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.3 Cg_endo -63.63 -35.31 59.4 Favored 'Trans proline' 0 N--CA 1.483 0.868 0 C-N-CA 122.555 2.17 . . . . 0.0 113.638 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.95 -50.73 65.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.209 -164.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.817 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -60.31 89.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.353 -163.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.494 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 57.3 mttt -148.69 149.81 32.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.393 -165.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.9 t -69.04 126.43 29.77 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.451 175.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.9 33.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.066 169.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' NZ ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -130.25 -49.53 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.198 179.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.447 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 29.3 p -113.5 -18.49 11.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.214 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.97 39.7 53.65 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -99.29 131.42 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.302 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 28.3 m -60.87 139.57 57.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.465 171.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 51.7 mt -103.07 121.75 43.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.359 -169.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -83.25 -169.08 2.36 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.48 -173.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.1 p -74.47 77.39 1.93 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.376 -167.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.42 56.1 1.72 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 168.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.75 11.87 4.25 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 166.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.817 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.2 p80 -107.36 -170.32 1.68 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.106 -0.547 . . . . 0.0 110.451 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.87 158.7 10.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.833 163.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 17.8 pt-20 -112.77 128.33 56.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.211 -160.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.479 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.44 151.97 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.419 157.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -62.67 75.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.003 -172.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.449 ' HA3' ' NZ ' ' A' ' 48' ' ' LYS . . . 162.45 -53.52 0.31 Allowed Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.715 -167.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -155.16 140.48 12.37 Favored Pre-proline 0 C--O 1.242 0.68 0 CA-C-O 121.39 0.614 . . . . 0.0 110.048 -163.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.9 Cg_endo -68.46 149.35 74.64 Favored 'Trans proline' 0 N--CA 1.486 1.032 0 C-N-CA 123.08 2.52 . . . . 0.0 113.708 166.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 8.4 m-85 -138.8 -173.65 3.62 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.79 167.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 86.0 m -57.52 134.59 56.24 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 113.458 -1.701 . . . . 0.0 110.348 164.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.88 -37.15 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.021 162.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.6 m-70 -152.68 169.82 9.04 Favored Pre-proline 0 CA--C 1.546 0.81 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 163.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.517 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 22.2 Cg_endo -66.12 -21.47 7.17 Favored 'Cis proline' 0 N--CA 1.491 1.347 0 C-N-CA 122.113 -2.036 . . . . 0.0 112.655 -19.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 73.4 m -57.11 -42.92 81.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.251 -153.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -61.03 -56.32 22.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.458 175.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.519 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -96.98 24.28 6.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.507 -166.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.256 174.01 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.428 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 5.3 Cg_exo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.59 158.77 29.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.355 -167.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.3 t -80.59 119.36 76.04 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.349 -161.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -61.1 -18.83 60.42 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.877 2.385 . . . . 0.0 113.198 167.852 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.452 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.9 OUTLIER -83.02 -77.65 0.24 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.424 -179.428 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -90.96 -20.12 22.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.918 -164.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.22 52.54 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.463 -173.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.81 -168.13 1.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.979 159.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 149.59 27.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.355 167.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.5 t -111.31 113.53 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.467 -161.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.4 ' HB3' ' CG ' ' A' ' 14' ' ' GLU . 1.4 t80 -77.7 158.75 29.53 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.457 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.11 -62.71 1.67 Allowed 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 -158.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.21 -13.29 61.87 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.813 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HB3' ' A' ' 11' ' ' TYR . 1.9 pm0 -102.78 52.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.783 167.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -115.81 148.63 39.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.527 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.856 HG21 HD22 ' A' ' 28' ' ' LEU . 10.2 m -137.35 141.25 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.478 151.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.8 m -105.34 131.03 53.29 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.523 -176.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.411 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.0 OUTLIER -168.71 122.72 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.197 -164.167 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.654 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.17 32.97 21.08 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.77 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.93 18.5 78.71 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 163.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -154.72 160.05 41.1 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 164.372 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.428 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -85.75 176.89 7.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.285 -165.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.6 m95 -152.91 -176.45 5.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.03 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 39.2 m80 -101.76 142.26 33.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.476 168.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -61.16 -50.59 83.47 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.732 -169.469 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 7.3 Cg_exo -57.38 -34.93 98.75 Favored 'Trans proline' 0 N--CA 1.483 0.9 0 C-N-CA 122.618 2.212 . . . . 0.0 113.545 174.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.8 m -65.74 -46.47 78.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.352 -169.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.857 HD21 ' CE1' ' A' ' 42' ' ' HIS . 11.3 tp -60.84 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.332 -165.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -139.73 146.63 39.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.327 -164.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.0 t -70.66 119.77 15.3 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 167.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -97.71 29.03 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.988 165.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tptp -110.48 -52.35 2.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.116 170.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.8 -24.36 10.91 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.752 -177.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.72 44.62 7.17 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 2.4 mmtm -111.15 119.82 40.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.306 -0.447 . . . . 0.0 110.401 168.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.5 m -61.08 161.72 8.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.319 168.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.879 HD13 ' HB2' ' A' ' 42' ' ' HIS . 5.0 mt -131.78 147.32 52.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.351 -165.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -83.47 -166.2 1.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.586 174.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.0 t -95.76 32.11 1.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.346 -169.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 167.22 57.36 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 164.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.25 12.0 2.29 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 114.763 -0.718 . . . . 0.0 111.825 170.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.879 ' HB2' HD13 ' A' ' 37' ' ' LEU . 2.3 p80 -112.75 -174.62 2.49 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.47 -175.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.62 -177.27 6.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 164.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.547 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 mp0 -140.72 114.77 9.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.059 -164.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.493 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -74.0 -167.84 0.54 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.821 157.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.39 86.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.199 -173.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.25 47.34 91.58 Favored Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.734 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.9 103.26 1.93 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 121.851 0.834 . . . . 0.0 109.848 -175.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 12.3 Cg_endo -66.87 145.2 73.76 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 122.594 2.196 . . . . 0.0 113.79 177.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -143.63 -168.32 2.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.848 171.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 69.2 m -57.51 134.56 56.2 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.197 161.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -61.28 -33.48 73.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.89 160.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.535 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 23.6 m-70 -157.13 163.81 23.78 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.193 164.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.3 Cg_endo -73.2 -17.42 17.31 Favored 'Cis proline' 0 C--N 1.354 0.828 0 C-N-CA 122.627 -1.822 . . . . 0.0 113.558 -14.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.3 m -59.5 -38.06 79.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.723 -155.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -62.35 -54.8 35.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.385 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.535 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.0 t -61.83 -12.69 18.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.464 -173.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.287 -179.169 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.099 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -131.11 156.41 45.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.432 170.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.1 t -83.09 118.93 73.18 Favored Pre-proline 0 C--O 1.25 1.086 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.435 -162.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.6 Cg_endo -60.15 -19.62 57.66 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.754 2.303 . . . . 0.0 113.373 167.806 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.08 -77.29 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.466 179.519 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.58 -19.74 21.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.725 -163.256 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 16.2 t70 71.78 64.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.455 -170.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -126.08 -168.01 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.167 162.722 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -103.93 148.83 25.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.289 163.759 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 56.1 t -115.92 110.95 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.723 -164.036 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.496 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 27.0 t80 -72.74 154.95 40.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.374 -179.314 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.496 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 15.9 m-85 -60.28 -61.38 2.64 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.945 -158.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.78 -1.18 13.1 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.613 -173.015 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -102.4 12.17 36.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.547 178.046 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -97.11 158.19 15.56 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.178 -160.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.818 HG21 HD22 ' A' ' 28' ' ' LEU . 17.7 m -146.53 145.94 19.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.471 156.386 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -114.39 137.42 51.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.904 -1.043 . . . . 0.0 110.669 -166.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.0 t -178.35 127.48 0.12 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.235 -171.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 59.94 34.87 21.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.557 -170.172 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.75 18.0 51.51 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.541 -1.023 . . . . 0.0 110.541 169.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.44 153.15 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 164.674 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.427 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.68 177.17 6.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.289 -165.535 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 26.1 m95 -150.39 175.56 11.73 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.064 -1.425 . . . . 0.0 109.383 -177.705 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.8 m80 -93.37 137.64 32.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.526 171.144 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.56 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 ttp180 -61.03 -46.43 96.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.83 -170.693 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -50.36 -48.32 20.61 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.704 2.269 . . . . 0.0 113.496 166.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.77 -51.53 67.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.231 -166.376 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.818 HD22 HG21 ' A' ' 16' ' ' VAL . 3.2 tp -60.24 91.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.404 -162.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.7 mtpt -140.96 154.18 45.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.357 -169.372 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.0 t -69.45 132.05 45.72 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.376 176.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HB2' ' CZ ' ' A' ' 50' ' ' TYR . 45.1 mm-40 -95.43 31.31 2.01 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.194 -1.367 . . . . 0.0 110.261 173.437 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.33 -48.54 0.53 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.189 -174.343 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.1 p -114.1 -10.74 12.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.245 178.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.41 23.35 77.56 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 172.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -103.74 136.23 43.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.911 -0.645 . . . . 0.0 110.402 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 m -61.94 142.56 57.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.451 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.533 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 60.1 mt -99.92 157.77 16.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.422 -173.082 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -101.9 -172.39 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.221 -167.748 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER -60.98 -22.09 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.445 -167.59 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 174.68 60.76 0.05 OUTLIER Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 170.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -115.2 11.61 19.8 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 166.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.527 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.1 p80 -102.04 -168.61 1.56 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.389 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.36 158.64 11.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.958 161.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.576 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -121.18 138.99 53.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.1 -163.632 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -130.43 109.21 10.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.76 173.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.488 ' HB3' ' HD2' ' A' ' 48' ' ' LYS . 1.4 tp10 58.4 43.34 19.91 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.663 -170.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.84 22.65 73.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -117.64 98.43 51.7 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-N 115.159 -0.52 . . . . 0.0 109.759 173.195 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.7 Cg_endo -64.33 155.18 67.14 Favored 'Trans proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.62 2.213 . . . . 0.0 113.572 -173.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 31' ' ' GLU . 76.3 m-85 -151.6 177.63 10.15 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.001 175.431 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.0 m -56.52 132.08 50.46 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.379 -1.737 . . . . 0.0 110.426 161.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.64 -30.06 69.64 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.978 163.332 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.474 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 34.4 m-70 -160.87 165.17 17.76 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.699 -1.137 . . . . 0.0 109.323 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.474 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.0 Cg_endo -72.89 -15.0 17.89 Favored 'Cis proline' 0 N--CA 1.483 0.898 0 C-N-CA 122.628 -1.822 . . . . 0.0 113.608 -13.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.6 m -59.54 -44.34 93.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.714 -157.02 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -61.78 -51.0 70.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.517 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -73.79 -15.25 61.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.342 -176.219 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.354 173.421 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.437 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 8.7 Cg_exo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.5 0.538 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HD3' ' HG2' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -119.52 155.99 31.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.413 -167.414 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.0 t -83.7 119.42 73.64 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.417 -164.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.6 Cg_endo -62.0 -17.78 57.87 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.794 2.329 . . . . 0.0 113.261 167.547 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.485 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -83.27 -76.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.449 179.593 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -92.79 -20.25 20.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.825 -163.19 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 t0 72.46 59.51 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.468 -171.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.53 -176.35 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.993 160.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.416 ' HG2' ' HD3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -98.26 148.0 24.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.528 172.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.1 t -111.96 112.96 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.546 -158.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 19.1 t80 -73.14 151.44 41.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.41 -179.343 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.41 -54.63 43.34 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.875 -159.211 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.91 -1.22 27.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.522 -170.115 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 13.22 28.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.339 175.73 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.45 153.49 22.45 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.283 -165.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -147.84 147.57 17.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.787 156.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -113.84 136.06 53.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.666 -168.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.1 t -177.74 131.33 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.417 -173.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.607 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.1 mm? 60.12 36.0 21.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.719 -175.918 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.11 18.59 67.13 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.9 157.84 43.88 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 165.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.437 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 4.1 m-20 -89.78 176.7 6.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.29 -168.344 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -149.49 179.13 8.2 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.101 -177.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -96.27 142.99 27.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.445 170.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.568 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 15.0 tpt180 -61.28 -45.22 95.15 Favored Pre-proline 0 CA--C 1.543 0.689 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.728 -166.369 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.5 Cg_endo -64.81 -37.17 36.48 Favored 'Trans proline' 0 N--CA 1.483 0.893 0 C-N-CA 122.586 2.191 . . . . 0.0 113.604 175.107 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.485 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.4 m -61.08 -48.31 82.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.208 -166.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.483 HD22 HG21 ' A' ' 16' ' ' VAL . 6.6 tp -60.4 89.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.425 -163.319 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.513 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 mttt -143.46 144.06 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.3 -165.595 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.6 t -63.25 119.52 9.78 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.47 167.413 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 6.9 pt-20 -97.22 35.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.758 164.037 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HE2' ' HE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -120.35 -48.71 2.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.205 173.161 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -112.6 -22.71 10.63 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 114.541 -1.208 . . . . 0.0 110.994 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.27 42.81 9.06 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -178.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -97.65 133.63 41.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.364 169.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.503 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 14.0 m -69.06 143.17 54.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.313 167.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.828 HD13 ' HB2' ' A' ' 42' ' ' HIS . 85.0 mt -109.19 158.88 17.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.262 -167.478 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -116.74 -169.05 1.56 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.549 -166.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.9 t -60.84 -23.1 64.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 -165.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.88 70.69 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -136.27 22.45 3.39 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 163.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.828 ' HB2' HD13 ' A' ' 37' ' ' LEU . 8.0 p80 -111.33 -168.43 1.31 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 114.792 -0.704 . . . . 0.0 110.486 -177.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -147.87 -166.64 2.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.776 165.661 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.607 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -163.13 137.81 6.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.077 162.624 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -103.09 112.68 25.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.831 166.053 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 58.28 31.7 21.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.742 165.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 116.35 -20.12 12.66 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.579 -1.008 . . . . 0.0 110.579 170.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -104.92 94.21 7.3 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 121.408 0.623 . . . . 0.0 109.853 -169.175 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.3 Cg_endo -64.44 158.07 51.37 Favored 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.374 2.05 . . . . 0.0 113.597 -177.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 88.2 m-85 -155.4 -164.6 1.8 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.074 174.304 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 98.1 m -56.48 135.52 54.31 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.435 161.458 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -61.12 -30.92 70.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.885 161.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.536 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 29.8 m-70 -161.65 164.97 17.21 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.333 165.915 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.3 -15.24 16.79 Favored 'Cis proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.529 -1.863 . . . . 0.0 113.555 -14.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.68 -40.34 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.657 -156.645 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -60.98 -35.61 77.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.471 172.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.1 t -84.58 -13.54 51.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.338 -174.295 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.229 -177.474 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.584 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 7.1 Cg_exo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 113.528 0.549 . . . . 0.0 113.528 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -147.05 136.47 22.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.485 -166.458 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -93.52 118.77 67.6 Favored Pre-proline 0 C--O 1.247 0.957 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.157 -167.741 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.66 -27.43 84.81 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.839 2.359 . . . . 0.0 113.196 168.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -73.02 0.19 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.388 -176.441 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.14 -16.2 22.77 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -165.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.23 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.569 -169.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 -167.82 1.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.01 158.332 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.31 145.58 30.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.379 165.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 48.5 t -107.71 110.25 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.746 -165.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -73.8 157.4 36.47 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -60.66 -63.13 1.4 Allowed 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.763 -160.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -3.83 19.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.372 -1.286 . . . . 0.0 111.79 -174.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.18 16.1 26.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 178.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -97.69 149.64 22.06 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.28 -163.543 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.781 HG21 HD22 ' A' ' 28' ' ' LEU . 12.5 m -142.2 119.07 6.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.483 154.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.7 m -88.05 133.36 33.99 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.287 -176.528 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.517 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.5 OUTLIER -160.9 120.67 2.69 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.337 -161.047 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.624 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.7 mm? 60.02 18.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.721 -177.641 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.21 -26.11 12.77 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 162.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.77 147.49 43.82 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.873 -0.663 . . . . 0.0 109.95 178.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -79.06 177.51 8.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.191 -163.264 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 46.2 m95 -151.46 -178.32 6.6 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 113.972 -1.467 . . . . 0.0 109.371 -177.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.1 m80 -98.49 145.59 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.488 171.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -62.62 -49.9 80.82 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.833 -173.512 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.7 Cg_exo -61.56 -32.28 87.69 Favored 'Trans proline' 0 N--CA 1.482 0.835 0 C-N-CA 122.744 2.296 . . . . 0.0 113.604 176.506 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -70.2 -49.49 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.149 -168.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.905 HD21 ' NE2' ' A' ' 42' ' ' HIS . 5.3 tp -64.51 82.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.329 -162.771 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -124.24 142.47 51.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.301 -170.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.6 t -63.24 128.62 36.67 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.37 170.533 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG3' ' HG2' ' A' ' 48' ' ' LYS . 4.9 mm-40 -95.81 37.32 1.22 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.159 169.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.38 -50.39 0.56 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.257 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -112.19 -18.75 12.48 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.043 -179.738 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.42 40.27 60.33 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 174.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -111.88 134.98 53.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.154 -0.523 . . . . 0.0 110.495 171.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 m -61.56 147.13 46.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.381 176.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 11.4 mt -109.23 170.25 8.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.355 -166.907 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 39' ' ' SER . 1.3 m -108.01 174.57 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.424 -165.404 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.442 ' H ' HG22 ' A' ' 38' ' ' THR . 7.1 t -64.98 69.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.371 171.118 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.71 55.42 1.65 Allowed Glycine 0 CA--C 1.531 1.045 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.3 12.84 5.74 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.589 -0.605 . . . . 0.0 111.589 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.905 ' NE2' HD21 ' A' ' 28' ' ' LEU . 3.2 p80 -115.14 -168.93 1.46 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.781 -0.71 . . . . 0.0 110.257 -177.609 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.67 157.78 12.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.894 161.403 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.574 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.46 128.68 56.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.007 -163.851 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.459 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.3 t60 -90.37 163.4 14.72 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.303 160.857 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.459 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 2.1 tt0 -60.43 92.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.119 -161.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.71 54.67 11.53 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.63 -169.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -179.74 101.84 0.18 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-O 121.451 0.643 . . . . 0.0 109.884 166.953 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.574 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.9 Cg_endo -65.1 150.25 88.06 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.803 2.335 . . . . 0.0 113.639 170.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 47.5 m-85 -147.61 -179.57 6.97 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.914 169.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.9 m -56.28 140.89 43.4 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.295 -1.775 . . . . 0.0 110.592 164.239 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -61.01 -32.95 72.52 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.12 168.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 33.5 m-70 -162.73 165.63 14.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.339 166.362 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.472 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -71.5 -11.33 15.39 Favored 'Cis proline' 0 C--N 1.354 0.831 0 C-N-CA 122.52 -1.866 . . . . 0.0 113.616 -14.344 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.4 m -59.82 -45.75 91.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 -157.842 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -61.28 -65.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.275 -178.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.447 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 73.1 m -65.27 -12.84 55.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.47 -170.237 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.426 171.599 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.88 148.12 49.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.36 -171.386 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.3 t -76.09 118.33 70.44 Favored Pre-proline 0 C--O 1.246 0.906 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.505 -163.469 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.601 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -60.22 -18.62 53.03 Favored 'Trans proline' 0 N--CA 1.489 1.21 0 C-N-CA 122.96 2.44 . . . . 0.0 113.211 167.295 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -84.99 -77.4 0.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.46 -178.14 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.8 p -89.87 -13.07 37.21 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.455 -167.231 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 60.2 54.59 3.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.574 -173.16 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.465 ' HA ' ' HD2' ' A' ' 8' ' ' LYS . 6.5 tptp -108.47 -168.37 1.35 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.767 157.081 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.96 155.3 18.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.595 161.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.7 t -114.24 113.28 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.504 -163.66 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.426 ' CE1' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t80 -73.35 157.79 36.3 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.359 177.076 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CE2' ' CE1' ' A' ' 11' ' ' TYR . 5.8 m-85 -60.55 -61.89 2.26 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.77 -159.819 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.38 -1.22 9.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.616 -173.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.557 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 15.8 mm-40 -101.96 12.98 36.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.69 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.24 152.12 18.64 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.277 -160.295 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.91 150.04 15.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.662 156.379 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 138.84 44.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.816 -170.677 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.453 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 27.8 t -177.3 132.76 0.17 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.341 178.007 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.634 HD23 ' OE1' ' A' ' 44' ' ' GLU . 3.4 mm? 60.15 38.0 20.51 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.533 -175.536 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.36 18.67 63.42 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 166.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -145.19 158.89 43.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.595 -0.302 . . . . 0.0 110.2 166.398 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.14 177.15 6.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.374 -167.729 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.601 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.84 -174.71 4.78 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 114.162 -1.381 . . . . 0.0 108.993 -177.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.0 m80 -100.9 142.38 32.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 113.803 -1.544 . . . . 0.0 110.555 170.136 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.6 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.23 -44.81 94.67 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.116 -174.211 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.6 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 6.0 Cg_endo -62.65 -28.65 77.03 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.503 2.135 . . . . 0.0 113.652 175.417 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.32 -50.85 11.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.294 -168.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.572 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.4 tp -65.2 75.78 0.05 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.301 -177.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 8.6 ttmt -147.52 139.54 24.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.431 -174.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.8 t -61.19 125.67 24.58 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.317 178.217 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HE1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -100.7 21.8 12.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.13 172.91 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HZ1' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -104.4 -58.6 1.86 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.162 166.063 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.404 ' HA ' ' HZ1' ' A' ' 32' ' ' LYS . 31.5 p -102.31 -33.34 9.63 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.407 -172.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.51 49.51 4.6 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.506 178.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.515 ' HB2' ' NZ ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -106.59 126.87 52.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.417 161.352 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.55 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 67.7 m -61.86 136.33 57.94 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.176 172.162 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 42' ' ' HIS . 34.3 mt -96.43 165.91 11.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.371 -160.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 39' ' ' SER . 2.0 m -112.12 177.93 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.296 -164.076 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 38' ' ' THR . 48.8 m -60.72 84.04 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.526 170.215 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 55.79 7.31 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 172.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -132.03 12.23 5.32 Favored Glycine 0 CA--C 1.524 0.651 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.608 162.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.572 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.3 p80 -105.48 -168.53 1.47 Allowed 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 114.72 -0.74 . . . . 0.0 110.399 177.336 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.517 ' HB2' HD22 ' A' ' 52' ' ' ASN . . . -168.66 157.58 8.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.804 160.079 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.634 ' OE1' HD23 ' A' ' 19' ' ' LEU . 5.7 pt-20 -120.83 125.48 47.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.131 -161.576 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.472 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 83.4 t60 -93.4 164.65 13.12 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 158.178 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.472 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 15.3 mm-40 -58.09 93.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 -157.124 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.0 56.38 5.82 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.746 -172.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HE2' ' NZ ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER 179.14 98.86 0.17 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-O 121.755 0.788 . . . . 0.0 110.02 163.009 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.471 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 32.5 Cg_endo -68.52 137.84 40.41 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.974 2.449 . . . . 0.0 113.503 166.06 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.9 m-85 -133.85 -163.8 1.41 Allowed 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.67 171.383 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.9 m -56.37 134.16 53.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.451 163.521 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.517 HD22 ' HB2' ' A' ' 43' ' ' ALA . 5.3 t-20 -60.93 -31.11 70.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.024 163.539 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.497 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 19.4 m-70 -158.62 166.39 16.57 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.206 164.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -66.26 -21.71 7.22 Favored 'Cis proline' 0 N--CA 1.49 1.276 0 C-N-CA 121.992 -2.087 . . . . 0.0 112.733 -20.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.9 m -56.54 -39.12 72.86 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.386 -152.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -64.73 -71.84 0.17 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.033 174.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.497 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 20.4 m -62.41 -14.16 37.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.54 -166.505 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.236 -173.845 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.491 0.535 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.4 149.0 47.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.29 169.488 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.1 t -83.55 117.27 68.17 Favored Pre-proline 0 C--O 1.249 1.047 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.221 -162.347 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.5 Cg_endo -59.46 -23.08 69.1 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.418 2.079 . . . . 0.0 113.069 169.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HG2' ' HD2' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -77.51 -72.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.545 -175.44 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.34 -20.45 19.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.755 -165.788 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.78 57.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.506 -172.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -118.57 -168.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.92 159.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -104.35 154.14 20.19 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.434 160.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 31.7 t -112.27 111.99 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.45 -162.21 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.57 33.1 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.554 -1.203 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -51.21 70.81 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.007 -156.453 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -0.37 29.33 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.444 -168.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -111.05 20.96 16.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.304 173.084 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.84 148.0 24.86 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.355 -169.717 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.95 117.53 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.661 154.256 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -97.34 142.58 29.04 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.521 -173.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.6 t -177.26 137.36 0.22 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.212 -169.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 4.7 mp 60.13 16.4 5.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.553 -172.874 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.6 -25.82 23.24 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 165.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.94 149.72 41.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 114.721 -0.739 . . . . 0.0 110.158 -178.135 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -85.76 177.53 7.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.217 -162.611 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 42.2 m95 -149.18 -175.84 5.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.376 179.27 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.6 m80 -98.22 148.52 23.52 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.468 173.389 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 tpp85 -61.58 -45.25 93.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.716 -168.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.0 Cg_endo -66.17 -40.28 15.87 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.538 2.159 . . . . 0.0 113.581 174.674 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.61 -53.26 59.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.301 -163.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 37' ' ' LEU . 1.6 tp -60.51 91.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.414 -163.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 mtmp? -152.18 148.05 27.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.353 -170.375 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.9 t -61.63 126.87 28.87 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.485 173.369 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.74 21.29 11.61 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.163 176.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.13 -61.25 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.358 165.952 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.0 p -100.54 -22.76 14.88 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.569 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.53 45.18 11.34 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.537 -1.025 . . . . 0.0 110.537 -175.842 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -99.99 120.98 40.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.463 . . . . 0.0 110.298 165.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.5 m -61.23 131.0 49.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.302 175.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 28' ' ' LEU . 21.3 mt -94.57 118.08 31.13 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 114.618 -1.173 . . . . 0.0 110.38 -174.024 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -60.15 -168.46 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.549 169.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -87.15 69.1 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.245 165.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 156.01 151.7 6.0 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.651 176.107 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.06 15.42 81.11 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.107 -1.044 . . . . 0.0 111.355 167.06 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.654 ' HB2' HD13 ' A' ' 37' ' ' LEU . 21.5 p80 -110.83 -166.51 1.08 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.722 -0.739 . . . . 0.0 110.853 172.343 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.452 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.95 159.63 9.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.191 -170.964 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.539 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -135.63 122.53 21.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.006 -165.092 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -128.86 102.15 6.41 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.197 -1.365 . . . . 0.0 109.972 177.037 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 58.6 47.47 13.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.643 -171.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.87 19.87 56.53 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.578 173.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HA ' ' HZ1' ' A' ' 5' ' ' LYS . 12.9 mmtm -110.4 98.38 35.92 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 170.347 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.616 ' HB2' HD12 ' A' ' 37' ' ' LEU . 9.7 Cg_endo -62.17 157.82 42.78 Favored 'Trans proline' 0 N--CA 1.486 1.042 0 C-N-CA 122.47 2.113 . . . . 0.0 113.638 -173.14 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 57.0 m-85 -158.32 173.55 16.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.994 -170.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.4 m -57.87 130.88 48.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.051 160.201 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -61.52 -31.91 71.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.81 160.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.5 m-70 -157.12 163.2 25.82 Favored Pre-proline 0 CA--C 1.553 1.076 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.162 165.07 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.428 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.71 -16.73 18.65 Favored 'Cis proline' 0 C--N 1.353 0.788 0 C-N-CA 122.665 -1.806 . . . . 0.0 113.651 -13.316 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.6 m -59.36 -44.99 92.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.711 -156.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -60.83 -52.73 63.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.507 174.456 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.472 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 7.6 t -63.31 -29.15 70.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.38 -173.421 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -170.524 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.466 ' H2 ' ' HD2' ' A' ' 2' ' ' LYS . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.946 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.55 158.2 22.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -168.619 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.8 t -86.84 122.75 71.3 Favored Pre-proline 0 C--O 1.247 0.972 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.165 -162.445 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.62 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -62.03 -30.18 82.59 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.846 2.364 . . . . 0.0 113.288 168.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -70.87 0.28 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.476 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -96.65 -14.22 22.27 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.485 -166.307 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.5 57.12 3.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.58 -169.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.71 -168.01 1.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.853 158.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -107.69 152.14 24.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.608 162.013 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.9 t -111.2 112.47 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.615 -163.636 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.35 152.98 44.65 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.308 175.596 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -60.52 3.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.777 -158.759 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.53 -11.8 61.05 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.744 -172.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.426 ' H ' ' HG2' ' A' ' 14' ' ' GLU . 3.9 pt-20 -102.81 42.6 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.173 170.984 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -108.82 152.72 24.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.384 -178.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.536 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -143.73 145.72 21.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.602 155.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.7 136.48 50.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.668 -166.204 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.422 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.0 t -177.99 136.45 0.17 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.466 -173.573 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.435 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.13 25.09 14.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.645 -177.671 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.75 -24.69 28.48 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 166.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 2' ' ' LYS . 3.3 tttp -118.09 165.98 13.11 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.752 -0.724 . . . . 0.0 110.21 -178.049 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.27 176.56 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.376 -166.293 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.62 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.4 m95 -148.53 -176.8 5.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 114.165 -1.379 . . . . 0.0 109.171 -178.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.932 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.4 m80 -102.98 141.83 35.11 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.473 169.309 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.96 -47.82 94.41 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.835 -174.549 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_exo -54.74 -27.3 51.43 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 C-N-CA 122.59 2.193 . . . . 0.0 113.609 172.624 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -83.38 -55.25 4.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.263 -167.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.536 HD22 HG21 ' A' ' 16' ' ' VAL . 3.4 tp -60.71 82.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.388 -171.126 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.75 144.9 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.393 -164.515 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.7 t -64.85 133.61 52.27 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.399 -171.281 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.34 25.42 6.28 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.439 175.143 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.476 ' HA ' ' NZ ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -130.68 -48.87 1.05 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.64 -179.597 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.8 p -109.68 -18.3 13.5 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.3 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.82 40.28 85.05 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 176.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.14 134.87 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.432 -0.384 . . . . 0.0 110.456 170.071 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.8 m -61.52 145.24 52.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.378 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.467 HD13 ' CB ' ' A' ' 42' ' ' HIS . 18.5 mt -106.9 143.31 35.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.398 -171.699 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -110.41 -169.45 1.47 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.523 -170.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.3 84.45 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 -167.476 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.87 55.52 4.12 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 167.39 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.58 12.28 4.58 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 167.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.467 ' CB ' HD13 ' A' ' 37' ' ' LEU . 12.3 p80 -108.09 -170.36 1.67 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.135 -0.533 . . . . 0.0 110.498 -178.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -177.96 157.13 1.12 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.423 161.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.492 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -136.96 153.25 50.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.07 -157.889 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 10.3 p80 -98.2 167.66 10.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.551 157.25 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.84 86.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.123 -170.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.49 -48.77 0.71 Allowed Glycine 0 CA--C 1.529 0.916 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.566 -178.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 3.6 mttt -137.33 111.53 9.17 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 121.439 0.638 . . . . 0.0 109.764 -160.225 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.492 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 15.3 Cg_endo -68.91 154.11 71.49 Favored 'Trans proline' 0 N--CA 1.484 0.959 0 C-N-CA 122.963 2.442 . . . . 0.0 113.599 167.805 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -143.21 -167.82 2.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.827 163.777 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.1 m -56.56 140.24 47.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.34 -1.754 . . . . 0.0 110.453 164.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.66 -34.81 74.85 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 114.407 -1.269 . . . . 0.0 110.118 164.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.529 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 41.3 m-70 -161.8 166.2 14.95 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.275 165.454 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.529 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.8 Cg_endo -71.81 -13.75 16.23 Favored 'Cis proline' 0 N--CA 1.481 0.783 0 C-N-CA 122.681 -1.8 . . . . 0.0 113.631 -12.309 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.1 m -59.68 -41.18 90.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.769 -157.194 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -61.17 -36.6 80.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.374 177.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.522 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -77.28 -28.48 53.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.342 -179.92 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.317 -167.937 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.55 0.558 . . . . 0.0 113.55 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -125.5 153.53 43.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.458 -168.928 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.9 t -77.36 117.59 66.37 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.438 -163.813 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.0 Cg_endo -62.11 -9.92 16.31 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 123.001 2.467 . . . . 0.0 113.344 168.133 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.98 -74.38 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.446 -177.295 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -91.94 -19.35 22.54 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.973 -167.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.4 t0 72.3 49.17 0.23 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.594 -177.229 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -106.13 -168.39 1.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.839 159.325 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.1 mt-10 -107.03 157.49 17.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.457 158.565 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 25.4 t -114.49 112.5 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.252 -159.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -73.79 159.51 32.81 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.189 -179.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -60.21 -63.08 1.43 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.85 -158.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -2.98 15.1 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.661 -174.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -101.79 15.59 28.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.264 178.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.41 138.96 36.76 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.478 -163.398 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.2 m -132.72 117.71 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.523 154.178 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 46.6 m -89.79 133.05 34.91 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.209 -176.117 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -161.51 125.91 3.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.376 -159.759 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.857 HD23 ' HG2' ' A' ' 44' ' ' GLU . 5.5 mp 59.98 19.67 8.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.764 167.137 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 124.42 -31.43 4.42 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 162.469 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -135.42 158.98 43.01 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 114.653 -0.774 . . . . 0.0 110.082 -177.188 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.32 178.06 8.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.236 -164.568 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 40.2 m95 -151.38 -177.48 6.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 113.791 -1.549 . . . . 0.0 109.216 -178.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -99.63 147.83 24.96 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.485 171.799 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 10.6 mmt180 -61.16 -48.77 90.97 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.712 -168.827 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 3.6 Cg_exo -64.56 -36.19 44.15 Favored 'Trans proline' 0 N--CA 1.483 0.901 0 C-N-CA 122.618 2.212 . . . . 0.0 113.613 175.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.436 ' HA ' ' NZ ' ' A' ' 29' ' ' LYS . 1.6 m -64.59 -54.06 38.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -165.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.829 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -62.73 90.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.374 -166.088 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.0 OUTLIER -140.74 152.03 44.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.414 -171.355 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -64.27 128.66 36.77 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.293 171.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 6.3 tp10 -95.7 35.25 1.39 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.199 171.859 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.47 -52.08 0.7 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.9 p -109.77 -17.57 13.64 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.17 -178.247 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.26 33.43 44.46 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.68 137.11 32.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.275 -0.462 . . . . 0.0 110.414 171.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.2 m -66.45 137.3 56.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.309 167.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.545 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 28.4 mt -100.05 149.95 22.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.394 -167.304 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -89.62 -162.42 0.88 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.63 -173.288 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -95.71 36.69 1.26 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.355 -174.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.2 57.83 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 164.486 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.68 12.97 4.52 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 166.37 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.829 ' NE2' HD21 ' A' ' 28' ' ' LEU . 7.3 p80 -111.66 -169.01 1.38 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 114.621 -0.789 . . . . 0.0 110.657 178.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -169.55 159.39 8.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.995 164.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.857 ' HG2' HD23 ' A' ' 19' ' ' LEU . 16.7 pt-20 -113.96 132.99 55.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.009 -161.677 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.498 ' CE1' ' CD1' ' A' ' 56' ' ' TYR . 0.7 OUTLIER -90.41 74.95 6.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.231 174.056 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 58.37 40.95 23.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.903 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.47 21.11 35.63 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.524 -1.03 . . . . 0.0 110.524 177.146 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.42 95.86 46.54 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-O 121.248 0.547 . . . . 0.0 109.794 168.294 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.545 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 9.3 Cg_endo -64.26 152.86 79.59 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 C-N-CA 122.577 2.185 . . . . 0.0 113.63 -167.49 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 90.9 m-85 -153.94 173.12 16.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.886 173.323 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 75.8 m -56.96 133.18 54.58 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.408 163.592 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -61.25 -35.28 76.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.075 163.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m-70 -153.02 167.32 13.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.25 163.05 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.2 Cg_endo -66.83 -21.4 7.77 Favored 'Cis proline' 0 N--CA 1.488 1.179 0 C-N-CA 122.394 -1.919 . . . . 0.0 112.807 -17.245 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.4 m -56.73 -48.79 76.98 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.282 -153.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.498 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 10.1 t80 -60.98 -49.76 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.505 -178.735 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.41 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 25.0 p -72.06 -19.15 61.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.461 -175.921 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.178 -167.356 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 113.516 0.545 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.96 134.39 44.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.419 -168.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 34.1 t -81.61 123.16 80.95 Favored Pre-proline 0 C--O 1.251 1.15 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.076 -165.304 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -63.8 -28.13 67.9 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 123.092 2.528 . . . . 0.0 113.25 169.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -70.61 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.415 -178.237 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -99.24 -26.08 14.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.716 -162.92 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.77 67.13 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.508 -167.58 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 6.9 tptp -125.51 -168.99 1.92 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.039 160.761 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -100.84 149.81 23.46 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.64 165.283 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.5 t -119.01 122.45 69.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.544 -163.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.529 ' HB3' ' HG3' ' A' ' 14' ' ' GLU . 26.9 t80 -88.36 152.09 22.16 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.387 -172.84 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HA ' ' HG3' ' A' ' 15' ' ' ARG . 90.4 m-85 -58.44 -59.51 5.24 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.468 -154.077 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -13.98 59.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.653 -174.166 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -107.1 42.87 1.23 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.563 164.923 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.917 ' HG2' HG12 ' A' ' 10' ' ' VAL . 11.6 mtt85 -99.75 170.59 8.45 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.128 161.351 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.674 HG21 HD22 ' A' ' 28' ' ' LEU . 19.8 m -150.08 149.06 14.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.524 153.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -115.13 136.8 52.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.841 -167.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 t -178.57 126.89 0.11 Allowed 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.991 -165.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 59.39 19.15 7.44 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.74 -170.629 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.7 -24.46 30.77 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 166.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -105.11 158.3 16.67 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.033 -0.584 . . . . 0.0 110.159 178.009 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -91.48 176.88 6.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.259 -166.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.563 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.1 m95 -153.15 166.34 32.81 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 114.016 -1.447 . . . . 0.0 109.149 -176.42 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -83.04 136.93 34.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.588 168.347 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.452 ' HG3' HG13 ' A' ' 16' ' ' VAL . 6.9 mtp180 -60.88 -43.81 92.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.95 -172.404 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -59.51 -37.15 90.81 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.596 2.197 . . . . 0.0 113.638 172.515 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.3 m -69.22 -47.62 64.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.161 -167.08 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.674 HD22 HG21 ' A' ' 16' ' ' VAL . 6.0 tp -60.6 86.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.391 -166.313 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.5 mtmm -145.46 142.17 29.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.367 -167.241 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -61.56 129.74 42.6 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.386 172.823 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -95.15 22.55 6.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.197 171.705 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 2.7 tptt -130.46 -35.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.464 -167.582 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.8 -17.78 5.78 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.342 171.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.46 41.45 51.79 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 177.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -109.11 136.97 47.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.437 172.384 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -61.04 148.37 40.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.472 177.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.2 mt -110.41 135.1 51.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.316 -168.012 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -93.46 -168.32 1.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.488 -167.091 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -60.66 -29.46 69.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.554 -164.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.82 62.03 0.1 Allowed Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -173.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.76 11.63 3.42 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.007 -0.596 . . . . 0.0 111.781 167.109 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.594 ' HB2' HD13 ' A' ' 37' ' ' LEU . 13.9 p80 -106.83 -169.45 1.55 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.823 -0.689 . . . . 0.0 110.711 178.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.75 ' HB2' HD22 ' A' ' 52' ' ' ASN . . . -149.51 -166.91 2.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.586 164.685 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 8.4 pt-20 -133.03 135.68 45.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.405 166.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.432 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.3 t60 -103.14 161.77 13.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 157.637 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.432 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 4.7 mt-10 -60.36 91.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.243 -159.429 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 136.91 -52.1 0.78 Allowed Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -174.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.0 144.52 35.51 Favored Pre-proline 0 C--O 1.242 0.695 0 CA-C-O 121.324 0.583 . . . . 0.0 109.939 -160.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.555 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -69.45 162.93 39.96 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.952 2.434 . . . . 0.0 113.675 169.527 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 94.2 m-85 -156.3 -170.76 3.46 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.913 166.274 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.1 m -58.0 130.47 46.69 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.755 -1.566 . . . . 0.0 110.117 163.666 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.75 HD22 ' HB2' ' A' ' 43' ' ' ALA . 3.3 t-20 -60.64 -32.66 71.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.993 163.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 30.7 m-70 -158.65 162.77 26.02 Favored Pre-proline 0 CA--C 1.551 0.991 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.254 162.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -73.61 -18.76 16.74 Favored 'Cis proline' 0 C--N 1.354 0.838 0 C-N-CA 122.651 -1.812 . . . . 0.0 113.829 -11.365 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.6 m -58.84 -43.08 90.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.961 -154.757 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -61.22 -60.19 4.14 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.32 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 36.7 t -65.4 -24.12 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.45 -173.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.222 -166.847 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.965 0 N-CA-C 113.588 0.572 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.68 157.35 28.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.453 -169.658 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.8 t -84.08 118.07 70.32 Favored Pre-proline 0 C--O 1.25 1.106 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.166 -162.279 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -60.03 -21.88 67.06 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.625 2.217 . . . . 0.0 113.106 170.051 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.48 -74.3 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.343 -176.647 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.37 -20.82 19.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.665 -165.111 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.8 t0 72.24 56.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.453 -171.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -116.45 -167.86 1.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.999 160.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.49 149.35 26.28 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.259 163.274 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -110.2 111.2 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.636 -164.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -78.81 163.73 25.1 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.318 179.831 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -60.52 -63.53 1.27 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.724 -159.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.19 -10.95 60.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.785 -174.534 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.6 44.3 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.238 170.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.55 141.44 47.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.607 -177.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.568 HG21 HD22 ' A' ' 28' ' ' LEU . 11.5 m -136.8 117.47 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.283 151.596 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -88.82 133.07 34.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.249 -175.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.7 121.37 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.435 -159.661 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HG3' ' A' ' 44' ' ' GLU . 5.5 mp 59.87 27.12 16.41 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.8 166.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.03 19.17 29.44 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 162.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -171.09 154.57 4.12 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 164.694 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.7 OUTLIER -80.15 176.68 9.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.261 -163.562 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.1 m95 -151.86 -176.12 5.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.353 -176.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -100.75 146.7 26.91 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.479 171.489 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.8 tpp85 -63.53 -47.31 83.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.831 -169.524 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -62.95 -31.45 77.07 Favored 'Trans proline' 0 N--CA 1.483 0.912 0 C-N-CA 122.525 2.15 . . . . 0.0 113.612 175.661 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -70.1 -43.94 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.188 -165.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.568 HD22 HG21 ' A' ' 16' ' ' VAL . 5.5 tp -69.04 77.59 0.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.27 -164.253 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 4.7 mtmt -137.44 149.65 47.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.412 -166.284 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -69.76 127.55 33.33 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.45 -178.517 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.65 18.35 20.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.712 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 55' ' ' CYS . 19.4 mmmt -101.3 -60.16 1.57 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.356 162.215 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.3 p -103.65 -35.9 8.09 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 -167.538 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 90.28 49.73 3.18 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 179.149 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.775 ' HE3' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -105.25 142.0 35.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.389 160.817 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.488 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 90.4 m -69.08 151.96 45.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.262 167.059 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.775 HD23 ' HE3' ' A' ' 35' ' ' LYS . 19.1 mt -116.94 156.92 26.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.26 -169.535 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -104.28 -168.21 1.46 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.627 -173.375 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.0 p -60.85 -26.38 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.547 -166.121 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.22 65.98 0.12 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -172.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.78 16.61 2.41 Favored Glycine 0 CA--C 1.521 0.443 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 168.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.716 ' HB2' HD13 ' A' ' 37' ' ' LEU . 10.3 p80 -111.93 -169.35 1.45 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.632 -177.286 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.413 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -144.24 -164.0 1.8 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.557 165.364 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -167.05 157.27 11.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.307 163.062 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.527 ' CE1' ' HH ' ' A' ' 50' ' ' TYR . 33.6 p80 -134.08 123.34 24.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.321 162.854 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 58.32 37.68 25.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.906 -178.841 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.09 23.15 69.51 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 165.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.64 99.95 25.92 Favored Pre-proline 0 C--O 1.244 0.784 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 168.672 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.8 Cg_endo -67.69 168.28 18.83 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.524 2.149 . . . . 0.0 113.614 -172.385 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HH ' ' CE1' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -152.98 -165.04 2.08 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.075 166.252 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.1 m -56.85 131.12 48.53 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.141 -1.39 . . . . 0.0 110.258 161.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -33.08 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.845 160.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 27.5 m-70 -156.66 163.68 24.18 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.23 163.591 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.85 -17.63 18.09 Favored 'Cis proline' 0 N--CA 1.481 0.757 0 C-N-CA 122.705 -1.79 . . . . 0.0 113.631 -12.019 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.3 m -59.35 -44.03 92.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.796 -155.778 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.98 -54.39 45.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.467 178.161 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -72.7 -35.24 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.323 -169.296 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.36 -177.086 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.522 ' HD2' ' HD3' ' A' ' 21' ' ' LYS . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.076 0 N-CA-C 113.486 0.533 . . . . 0.0 113.486 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -126.22 159.61 32.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.409 -171.225 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -86.08 119.27 71.62 Favored Pre-proline 0 C--O 1.249 1.046 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.199 -167.228 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -59.4 -23.75 71.67 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.655 2.237 . . . . 0.0 113.19 169.552 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -73.21 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.409 -178.53 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -97.69 -21.59 16.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.712 -161.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 73.42 67.18 0.1 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.559 -170.404 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.13 -171.19 2.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.102 159.618 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -102.22 154.94 18.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.757 166.232 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.907 HG22 ' NE2' ' A' ' 24' ' ' HIS . 59.1 t -124.19 112.03 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.828 -160.845 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.484 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.3 t80 -73.83 164.79 26.17 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.376 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -60.74 -56.93 15.32 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.798 -160.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.93 59.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.438 -1.255 . . . . 0.0 111.621 -174.311 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.646 ' O ' HG13 ' A' ' 10' ' ' VAL . 6.3 pt-20 -111.2 37.81 2.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.965 163.921 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.806 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -119.33 131.23 55.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.039 164.135 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.425 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 29.1 m -109.58 178.51 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.525 156.718 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.67 142.61 51.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.662 -176.461 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.423 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.6 t -177.77 136.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.376 170.545 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.08 29.12 18.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.593 -173.481 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.41 18.15 73.19 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 168.259 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HD3' ' HD2' ' A' ' 1' ' ' PRO . 9.0 mmtp -142.86 150.97 40.57 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 164.52 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 1.1 m-20 -81.3 178.33 8.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.314 -164.102 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.3 m95 -151.08 160.18 44.05 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.4 -179.347 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.907 ' NE2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -78.19 136.21 37.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.365 166.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.79 -43.86 93.19 Favored Pre-proline 0 CA--C 1.545 0.763 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.786 -170.87 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.0 Cg_endo -64.07 -23.79 67.04 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.351 2.034 . . . . 0.0 113.604 175.71 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.38 -45.62 21.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.313 -173.086 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.562 HD23 ' HB2' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -73.23 91.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.907 . . . . 0.0 110.346 -170.19 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.566 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 5.1 mtmt -152.6 141.56 21.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.385 -167.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -61.79 126.26 26.73 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.471 171.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.56 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 13.4 tp10 -97.21 20.32 11.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 170.942 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -107.36 -62.34 1.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.189 165.86 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.6 p -102.46 -19.17 15.02 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.776 -168.39 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.39 34.92 30.96 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.306 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -88.83 126.9 35.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.307 169.524 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.566 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 94.4 m -60.91 135.6 57.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.211 163.831 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 42' ' ' HIS . 81.2 mt -99.49 104.43 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.387 -163.528 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -111.1 -168.63 1.33 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.395 -169.123 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 40.5 t 58.63 -89.02 0.02 OUTLIER 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.731 162.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.96 47.32 0.07 OUTLIER Glycine 0 CA--C 1.529 0.931 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 159.35 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -116.28 20.2 12.72 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -163.175 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.652 ' HB3' HD22 ' A' ' 37' ' ' LEU . 9.2 p80 -101.4 -169.57 1.71 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.916 -0.642 . . . . 0.0 110.711 177.011 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -175.41 159.51 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.14 167.803 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.446 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -117.62 137.45 52.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.068 -162.495 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -117.81 116.12 26.36 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 158.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 1.4 mt-10 60.74 -148.04 0.44 Allowed 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.439 -151.343 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.56 36.36 3.86 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 165.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -109.55 88.33 6.19 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-O 121.241 0.544 . . . . 0.0 109.786 171.757 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.3 Cg_endo -65.89 154.2 74.93 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.493 2.128 . . . . 0.0 113.58 -176.496 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 7.8 m-85 -148.16 -165.81 2.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.795 164.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 80.5 m -59.22 135.82 57.76 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.938 161.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -60.33 -34.72 74.22 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.254 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.9 m-70 -156.09 172.85 5.52 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.313 164.162 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.0 Cg_endo -63.35 -18.02 5.2 Favored 'Cis proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.431 -2.32 . . . . 0.0 112.533 -22.263 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.8 m -57.19 -45.2 83.93 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.221 -154.644 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -60.88 -49.03 79.11 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.317 -174.328 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.413 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -68.84 -42.24 77.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.495 178.145 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 -170.216 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.72 150.77 51.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.391 -168.958 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.4 t -84.47 117.6 69.11 Favored Pre-proline 0 C--O 1.25 1.127 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.253 -164.201 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.16 -20.08 66.33 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 C-N-CA 122.784 2.322 . . . . 0.0 113.254 170.056 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.501 ' HG3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -78.97 -73.48 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.464 -177.543 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.61 -21.98 18.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.527 -164.487 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 72.55 64.56 0.12 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.501 -169.061 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -125.38 -168.58 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.083 161.465 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.66 151.63 23.46 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.592 161.922 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 33.9 t -112.21 112.57 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.494 -161.296 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.78 151.43 35.98 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.251 179.381 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -60.22 -49.38 77.86 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.007 -158.398 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.3 -0.78 33.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.472 -167.487 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -104.24 4.39 33.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 174.378 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.57 152.88 33.77 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.312 -160.811 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 28' ' ' LEU . 21.7 m -150.29 136.8 12.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.754 159.116 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.9 m -113.19 135.11 54.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.505 -165.603 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.41 ' OG ' HD22 ' A' ' 19' ' ' LEU . 22.4 t -178.01 136.01 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.536 -165.692 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 60.14 21.64 10.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.593 -174.42 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 16.89 79.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 169.407 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 158.84 43.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 163.15 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.06 176.84 7.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.249 -164.816 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 30.9 m95 -150.13 179.94 7.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 113.983 -1.462 . . . . 0.0 109.227 -179.275 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 41.8 m80 -96.03 150.88 19.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.425 166.559 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.583 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -61.48 -58.91 15.42 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.875 178.336 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 13.3 Cg_endo -54.28 -22.79 27.62 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 122.188 1.925 . . . . 0.0 113.619 -177.426 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.501 ' HB3' ' HG3' ' A' ' 5' ' ' LYS . 8.0 m -81.45 -53.97 5.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.382 -172.247 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.85 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -63.71 93.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.482 -161.843 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -142.49 146.67 34.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.408 -176.79 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -60.09 126.51 27.82 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.541 174.287 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.499 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 1.2 tt0 -94.75 27.7 2.97 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.104 172.116 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -124.19 -55.8 1.66 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.468 173.668 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.9 p -107.4 -21.8 12.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.832 -172.546 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.96 51.42 23.97 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -171.348 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 tptm -98.05 123.47 42.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.14 163.566 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.4 m -61.43 133.46 55.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.118 170.096 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.455 HD13 ' HB2' ' A' ' 42' ' ' HIS . 94.8 mt -98.2 138.03 36.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.426 -161.733 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 40' ' ' GLY . 68.7 m -60.42 150.28 31.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.268 165.406 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.0 t -64.84 65.9 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.63 162.204 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 38' ' ' THR . . . 138.69 150.04 5.54 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.527 -164.536 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.82 14.74 82.05 Favored Glycine 0 C--N 1.344 0.986 0 C-N-CA 119.934 -1.127 . . . . 0.0 111.37 171.926 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.85 ' CE1' HD11 ' A' ' 28' ' ' LEU . 8.3 p80 -120.11 -167.03 1.37 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 113.993 -1.104 . . . . 0.0 110.809 175.141 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -156.66 -165.63 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.899 -173.442 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.4 172.76 5.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.99 164.206 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.474 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 34.4 p80 -130.83 104.73 7.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.353 162.406 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 58.45 42.8 20.56 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.884 177.023 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 110.67 -18.91 26.65 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 166.948 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -98.73 101.11 11.01 Favored Pre-proline 0 C--O 1.243 0.752 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 -170.934 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 10.6 Cg_endo -65.82 157.99 56.08 Favored 'Trans proline' 0 N--CA 1.487 1.109 0 C-N-CA 122.472 2.115 . . . . 0.0 113.533 -171.059 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 62.8 m-85 -152.45 -176.75 5.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.052 169.964 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 71.3 m -57.42 134.2 55.83 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.029 158.908 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 5.8 t30 -69.47 -29.5 67.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.761 160.699 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.9 m-70 -153.59 161.03 30.21 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.153 164.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 10.0 Cg_endo -73.62 -16.79 18.45 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 122.685 -1.798 . . . . 0.0 113.675 -12.516 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -59.4 -53.45 58.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.752 -156.161 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -61.03 -48.1 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.5 178.762 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.1 p -65.53 -21.21 66.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.33 -176.762 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.16 -168.661 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.587 ' H2 ' ' HD3' ' A' ' 2' ' ' LYS . 5.4 Cg_exo . . . . . 0 N--CA 1.485 0.991 0 N-CA-C 113.503 0.54 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.587 ' HD3' ' H2 ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -135.09 132.26 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.414 -175.191 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.9 t -80.68 121.69 81.44 Favored Pre-proline 0 C--O 1.251 1.134 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.029 -162.66 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -63.43 -27.13 70.63 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 C-N-CA 122.957 2.438 . . . . 0.0 113.311 174.256 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -73.3 0.25 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.288 -179.178 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.5 p -91.95 -22.86 19.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.748 -160.998 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.6 t0 72.39 67.74 0.13 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.482 -169.809 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.0 OUTLIER -127.17 -168.77 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.156 162.155 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 152.93 22.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.601 162.254 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 74.9 t -122.04 110.46 27.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.945 -163.765 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -73.32 162.54 29.23 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.423 -178.666 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.486 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.7 OUTLIER -60.97 -55.73 29.52 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.822 -161.594 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.48 -9.25 59.57 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.579 -174.195 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.536 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 2.2 mt-10 -112.49 35.79 3.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.129 163.38 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.799 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -119.08 136.39 54.17 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.097 165.253 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.696 HG21 HD22 ' A' ' 28' ' ' LEU . 16.1 m -123.76 135.56 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.514 156.42 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 3.4 m -103.57 138.43 40.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.485 -170.685 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.491 ' C ' HD22 ' A' ' 19' ' ' LEU . 5.1 t -170.39 131.39 0.94 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.383 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.643 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.99 17.58 6.79 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.571 -173.355 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.81 -25.37 22.82 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 165.35 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 148.52 43.62 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.773 -0.714 . . . . 0.0 110.232 -178.27 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -81.78 177.6 8.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.17 -164.071 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.9 m95 -151.09 163.81 37.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.048 -1.433 . . . . 0.0 109.377 -177.147 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -84.6 140.11 31.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.593 170.426 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.537 ' CG ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.26 -44.21 92.55 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.961 -167.524 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD3' ' CG ' ' A' ' 25' ' ' ARG . 9.1 Cg_exo -51.96 -47.73 25.11 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.752 2.301 . . . . 0.0 113.424 166.446 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 m -63.95 -46.01 86.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.467 -165.717 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.86 HD21 ' CE1' ' A' ' 42' ' ' HIS . 1.6 tp -62.4 92.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -169.993 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.586 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 9.7 mtpm? -143.3 140.08 30.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.392 -170.111 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 10.7 t -60.23 129.11 40.07 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.448 171.363 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -98.81 39.78 1.24 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.095 -1.412 . . . . 0.0 110.242 172.458 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -143.23 -43.8 0.29 Allowed 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.362 -175.674 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.2 p -115.25 -19.05 10.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.006 173.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.84 41.78 54.9 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 179.41 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.402 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.86 133.56 44.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.315 169.667 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.2 m -60.74 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.299 168.461 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.865 HD13 ' HB2' ' A' ' 42' ' ' HIS . 96.5 mt -97.9 132.62 43.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.308 -164.82 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -106.03 -168.67 1.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.524 -166.246 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.6 t -60.91 89.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.433 -165.067 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.57 55.45 20.34 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 163.825 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.5 21.55 2.73 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 164.537 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.865 ' HB2' HD13 ' A' ' 37' ' ' LEU . 9.7 p80 -115.17 -166.9 1.16 Allowed 'General case' 0 CA--C 1.524 -0.057 0 CA-C-N 114.92 -0.64 . . . . 0.0 110.581 -176.747 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.41 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -161.4 -164.46 1.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.706 -169.452 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.4 148.89 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.177 163.065 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.503 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 9.1 p80 -91.13 165.35 13.54 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.458 157.051 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.68 87.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.1 -167.832 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 145.16 -61.5 0.49 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.581 -1.007 . . . . 0.0 110.581 -169.149 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -135.33 142.34 41.13 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-O 121.693 0.758 . . . . 0.0 109.78 -162.108 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.586 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 13.6 Cg_endo -72.42 158.31 51.56 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.865 2.377 . . . . 0.0 113.757 173.697 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 34.2 m-85 -147.0 178.01 8.69 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.946 168.74 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -56.44 140.44 45.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.474 163.25 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -60.66 -34.26 74.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.111 165.202 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.541 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.8 m-70 -162.63 166.42 13.73 Favored Pre-proline 0 CA--C 1.552 1.019 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.331 165.556 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -71.91 -13.15 16.54 Favored 'Cis proline' 0 C--N 1.353 0.774 0 C-N-CA 122.745 -1.773 . . . . 0.0 113.569 -12.7 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.8 m -59.82 -41.26 90.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.68 -157.286 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -61.06 -38.2 85.36 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.367 176.856 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.541 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -75.77 -18.19 59.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.464 176.503 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.143 -168.79 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.461 ' CD ' ' HE2' ' A' ' 21' ' ' LYS . 5.6 Cg_endo . . . . . 0 N--CA 1.486 1.03 0 N-CA-C 113.562 0.562 . . . . 0.0 113.562 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 28.9 mttp -133.53 156.63 47.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.455 170.591 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.3 t -86.1 123.28 72.0 Favored Pre-proline 0 C--O 1.25 1.128 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.167 -164.355 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.619 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -62.65 -30.31 78.68 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.808 2.338 . . . . 0.0 113.164 169.424 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -69.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.495 -175.313 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -98.33 -22.58 16.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 -165.178 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.9 59.68 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.52 -171.543 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.458 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -124.59 -172.06 2.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.142 159.2 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -100.76 153.1 19.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.7 168.803 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -118.12 113.46 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.74 -164.261 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.545 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 34.9 p90 -82.17 163.88 21.64 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.359 -178.095 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.541 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 m-85 -58.12 -59.5 5.2 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.26 -153.288 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.35 -11.24 59.81 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.698 -174.615 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.677 ' O ' HG13 ' A' ' 10' ' ' VAL . 14.4 mt-10 -108.2 46.2 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.807 164.32 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' HD2' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -118.59 141.34 48.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.699 161.91 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -136.81 131.52 47.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.712 157.695 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 34.3 m -97.98 144.19 27.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.481 -164.531 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.658 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 23.8 t -171.39 130.11 0.72 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.43 -171.035 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.17 15.08 4.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.698 -168.577 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.19 -24.58 31.57 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 170.661 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.461 ' HE2' ' CD ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -110.98 140.31 45.6 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 114.806 -0.697 . . . . 0.0 110.091 -178.897 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 5.6 m-20 -77.77 177.92 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.212 -161.299 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.619 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 31.7 m95 -150.59 171.15 17.56 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 113.82 -1.536 . . . . 0.0 109.279 179.739 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.4 m80 -88.75 149.14 23.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.506 174.925 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 tpp180 -61.32 -45.73 95.01 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.876 -170.975 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -64.24 -34.89 54.54 Favored 'Trans proline' 0 N--CA 1.484 0.956 0 C-N-CA 122.582 2.188 . . . . 0.0 113.601 174.378 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.31 -47.4 61.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.216 -164.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.867 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.5 tp -61.72 83.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.296 -168.444 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -144.88 152.0 39.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.442 -165.567 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -70.05 138.67 52.3 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.459 -177.777 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG3' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -89.65 -23.31 21.93 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.735 174.555 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -71.08 -64.63 0.87 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.957 172.81 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.1 p -108.47 -19.79 13.33 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.965 -159.493 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.73 42.82 53.1 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 177.627 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -100.19 136.52 39.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.346 166.3 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 m -60.69 146.19 46.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.323 170.891 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 96.5 mt -110.38 153.05 25.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.288 -163.231 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 39' ' ' SER . 14.5 m -105.83 170.29 7.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.452 -163.569 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.581 ' H ' HG22 ' A' ' 38' ' ' THR . 4.5 t -61.64 -17.67 56.31 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.459 -168.344 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.91 57.19 0.14 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.97 11.61 3.63 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 114.917 -0.642 . . . . 0.0 111.753 166.889 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.867 ' NE2' HD21 ' A' ' 28' ' ' LEU . 27.6 p80 -111.11 -169.8 1.52 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.144 0.497 . . . . 0.0 111.007 -177.662 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -154.24 -165.14 2.01 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.871 167.949 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.508 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.84 158.41 4.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.126 171.516 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.422 ' N ' ' HG2' ' A' ' 44' ' ' GLU . 10.1 p80 -123.2 172.76 8.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.957 157.947 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -61.42 91.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.192 -163.906 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.65 -65.77 0.34 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -169.181 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HD2' ' CE2' ' A' ' 50' ' ' TYR . 2.6 pttp -152.89 138.98 12.07 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-O 121.91 0.862 . . . . 0.0 109.961 -163.501 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.594 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 20.5 Cg_endo -69.28 170.01 16.98 Favored 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.934 2.422 . . . . 0.0 113.572 170.127 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -153.64 -164.99 2.02 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.908 162.859 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 89.0 m -57.19 136.82 56.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.259 159.973 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -31.93 71.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.938 163.606 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.536 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.9 m-70 -161.51 165.99 15.62 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.305 165.466 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -72.03 -14.25 16.56 Favored 'Cis proline' 0 N--CA 1.482 0.8 0 C-N-CA 122.557 -1.851 . . . . 0.0 113.582 -13.934 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.0 m -59.81 -42.3 93.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.682 -157.11 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -61.0 -39.25 88.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.53 176.083 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 15.9 t -84.54 -12.42 54.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -173.901 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.32 175.906 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.407 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 141.02 46.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.388 -168.734 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.9 t -82.25 117.02 66.92 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.164 -163.917 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.83 -21.92 72.06 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.727 2.285 . . . . 0.0 113.216 170.049 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? -76.42 -71.1 0.41 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.482 -175.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.64 -22.72 16.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.582 -164.991 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.47 55.49 0.15 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.503 -171.38 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.479 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -117.5 -169.25 1.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.948 159.771 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.94 148.43 25.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.65 167.096 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.7 t -109.7 111.09 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.651 -167.053 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 34.7 t80 -74.79 159.03 32.47 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.306 178.01 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.463 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 6.7 m-85 -60.58 -62.38 1.9 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.75 -160.118 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -1.72 11.63 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.72 -173.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -102.27 14.06 32.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.379 178.625 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -96.6 151.41 19.63 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.33 -161.496 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.522 HG21 HD22 ' A' ' 28' ' ' LEU . 16.0 m -143.9 145.02 22.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.601 156.19 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.1 m -115.71 136.26 53.23 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.715 -166.965 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 t -178.43 128.69 0.12 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.195 -169.316 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.12 34.97 21.23 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.605 -172.479 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.46 18.13 60.68 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 168.119 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -141.4 155.3 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 165.284 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -90.95 176.58 6.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.403 -165.822 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.583 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 26.2 m95 -149.8 -177.88 6.14 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.24 -177.079 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -99.2 145.97 26.66 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.553 168.928 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.1 mtp180 -61.22 -48.65 91.05 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.726 -168.899 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -64.0 -34.8 57.68 Favored 'Trans proline' 0 N--CA 1.483 0.87 0 C-N-CA 122.492 2.128 . . . . 0.0 113.647 177.049 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.01 -45.39 89.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.338 -166.131 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.638 HD21 ' NE2' ' A' ' 42' ' ' HIS . 9.6 tp -60.41 93.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.316 -162.173 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 2.2 mttt -141.02 153.58 45.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.331 -164.268 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -73.35 126.4 30.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.403 173.27 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 19.3 mt-10 -96.09 33.46 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.046 168.509 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -128.05 -52.8 1.31 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.077 175.619 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.21 -18.81 13.21 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.018 -177.462 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.12 36.42 40.63 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.384 -1.086 . . . . 0.0 110.384 175.762 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -100.39 137.0 39.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.476 170.38 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 23.3 m -66.96 147.96 52.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.433 170.315 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.766 HD13 ' CB ' ' A' ' 42' ' ' HIS . 6.9 mt -113.08 154.25 26.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.269 -169.939 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.2 m -154.28 158.24 39.9 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.128 -160.597 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m 60.59 11.96 3.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.122 171.519 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 59.19 54.45 37.81 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.201 -1.159 . . . . 0.0 110.201 -159.406 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.82 6.61 83.5 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 114.634 -0.783 . . . . 0.0 111.959 177.675 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.766 ' CB ' HD13 ' A' ' 37' ' ' LEU . 5.6 p80 -107.07 -172.18 2.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.38 -166.195 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.88 -163.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.813 163.897 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.8 tt0 -147.86 133.85 19.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.258 176.497 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.14 125.28 26.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 162.936 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.27 -150.19 0.42 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 -152.753 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -96.0 32.46 6.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 166.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -117.84 99.16 52.1 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-O 121.702 0.763 . . . . 0.0 109.799 170.724 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.0 Cg_endo -58.81 165.34 8.36 Favored 'Trans proline' 0 N--CA 1.486 1.04 0 C-N-CA 122.161 1.907 . . . . 0.0 113.649 173.302 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.517 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -153.73 -165.46 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.072 171.311 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 72.4 m -57.45 133.21 55.0 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.351 162.543 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -60.7 -31.01 70.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.926 161.469 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.1 m-70 -159.4 162.24 25.94 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.115 163.858 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -74.28 -17.42 18.95 Favored 'Cis proline' 0 N--CA 1.482 0.805 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.552 -14.093 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.19 -37.05 76.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.796 -155.311 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -62.49 -60.63 3.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.384 172.079 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 1.6 m -71.74 -17.19 62.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.414 -166.2 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.334 171.651 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.486 1.064 0 N-CA-C 113.554 0.559 . . . . 0.0 113.554 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.515 ' HG2' ' NZ ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -144.36 144.31 31.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.375 169.635 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -87.79 118.89 70.28 Favored Pre-proline 0 C--O 1.251 1.136 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.135 -164.56 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -60.97 -27.15 84.35 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.712 2.275 . . . . 0.0 113.211 169.108 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -69.78 0.36 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.459 -173.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -96.59 -22.07 17.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.621 -166.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.05 53.73 0.19 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.45 -171.238 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 -167.91 1.25 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.001 160.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.48 149.09 26.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.269 162.803 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 52.0 t -109.62 111.15 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.667 -166.502 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.485 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.6 t80 -78.84 161.76 26.54 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.282 178.117 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.68 -62.64 1.73 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.966 -157.723 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -10.83 60.16 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.779 -173.681 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.8 pt-20 -103.04 43.09 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.189 171.15 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -111.84 147.31 36.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.548 -177.45 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -140.43 143.15 29.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.459 154.188 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.9 m -115.61 133.82 55.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.616 -166.617 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.475 ' OG ' HD22 ' A' ' 19' ' ' LEU . 17.1 t -178.3 136.68 0.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.333 -171.4 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.97 29.43 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.65 -172.992 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.23 17.33 70.06 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 167.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' NZ ' ' HG2' ' A' ' 2' ' ' LYS . 1.2 tttm -143.64 160.13 41.22 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 164.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.02 177.34 6.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.306 -165.686 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 27.6 m95 -151.94 -174.94 5.03 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.116 -178.84 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.8 m80 -101.4 146.99 26.87 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.543 169.546 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.572 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 51.1 ttp180 -60.98 -47.14 96.35 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.727 -168.75 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -63.43 -35.36 61.47 Favored 'Trans proline' 0 N--CA 1.484 0.936 0 C-N-CA 122.55 2.166 . . . . 0.0 113.576 175.483 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -67.1 -50.81 60.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.328 -163.236 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.429 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.3 tp -60.37 89.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.339 -163.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.3 ttmm -147.57 141.96 26.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.321 -164.95 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.5 t -60.83 119.71 8.73 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.283 165.627 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -96.91 27.2 4.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.962 168.02 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.73 -55.71 2.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.092 169.165 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.3 p -106.96 -24.52 11.98 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.652 -174.351 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.79 45.3 7.3 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -177.436 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.24 124.87 46.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.304 168.137 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 m -61.0 139.48 58.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.269 168.109 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 75.0 mt -103.39 127.03 50.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.273 -165.371 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -69.57 -170.21 0.28 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.565 169.603 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -105.14 18.15 22.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.6 -168.474 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.696 ' H ' HG23 ' A' ' 38' ' ' THR . . . -178.62 58.71 0.09 OUTLIER Glycine 0 CA--C 1.531 1.048 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 162.334 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.25 10.98 1.56 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.88 168.446 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 14.6 p80 -113.4 -169.09 1.43 Allowed 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.415 -0.392 . . . . 0.0 110.868 -175.913 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -154.08 -164.17 1.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.909 168.201 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.3 pp20? -164.08 139.52 6.11 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.085 170.638 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.421 ' CG ' ' N ' ' A' ' 46' ' ' GLU . 57.0 t60 -95.3 161.99 13.86 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.3 159.951 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 28.6 mm-40 -61.44 88.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.049 -166.364 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.18 -66.0 0.35 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.304 -1.119 . . . . 0.0 110.304 -167.059 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.14 141.91 19.09 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.422 0.63 . . . . 0.0 109.82 -163.445 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.54 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.7 Cg_endo -68.44 160.05 50.82 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.967 2.445 . . . . 0.0 113.734 169.552 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 60.8 m-85 -147.63 -163.35 1.75 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.568 164.426 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.2 m -56.94 138.36 54.13 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.265 159.078 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -60.73 -35.84 77.37 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.988 164.113 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.477 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 27.4 m-70 -157.85 165.14 19.3 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.227 164.423 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -73.07 -15.36 18.1 Favored 'Cis proline' 0 C--N 1.354 0.868 0 C-N-CA 122.512 -1.87 . . . . 0.0 113.595 -14.192 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.8 m -59.61 -39.42 84.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.619 -156.636 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -61.15 -56.99 14.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.351 171.919 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.477 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -65.66 -26.52 67.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.399 -169.418 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.321 -169.896 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.443 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 12.1 Cg_endo . . . . . 0 N--CA 1.486 1.044 0 N-CA-C 113.617 0.583 . . . . 0.0 113.617 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.442 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -143.9 152.83 41.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.461 -167.063 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -89.99 118.01 68.55 Favored Pre-proline 0 C--O 1.249 1.043 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.177 -165.657 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -57.89 -26.82 76.05 Favored 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.61 2.207 . . . . 0.0 113.175 168.933 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -74.45 -73.41 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.417 -174.885 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -93.87 -21.8 19.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 -165.683 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 t0 72.59 58.63 0.13 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.526 -172.601 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' NZ ' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -119.74 -168.96 1.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.027 159.452 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 3.7 mt-10 -102.71 154.03 19.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.696 162.851 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 37.1 t -113.5 114.06 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.452 -162.85 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.62 154.79 41.51 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.365 177.125 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.65 -62.24 2.0 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.847 -159.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.44 -1.22 10.12 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.648 -173.399 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -102.57 14.09 32.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.466 178.315 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 153.27 17.97 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 -160.815 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.804 HG21 HD22 ' A' ' 28' ' ' LEU . 15.1 m -145.11 151.15 15.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.699 155.703 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -115.41 136.23 53.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.724 -168.726 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.504 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 23.1 t -177.84 135.75 0.18 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.279 -177.923 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.3 mm? 60.04 28.41 17.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -169.844 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.27 18.21 64.86 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 170.22 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.558 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -138.05 153.85 49.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 164.893 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -87.87 176.35 7.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.412 -165.973 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.4 m95 -147.52 -177.99 6.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.134 -176.907 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.3 m80 -100.96 141.36 33.96 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.965 -1.471 . . . . 0.0 110.526 167.691 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.35 84.97 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.827 -168.251 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.562 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -58.5 -35.65 98.4 Favored 'Trans proline' 0 N--CA 1.483 0.905 0 C-N-CA 122.608 2.205 . . . . 0.0 113.538 174.78 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.91 -43.5 98.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.114 -168.832 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.985 HD11 ' CE1' ' A' ' 42' ' ' HIS . 11.9 tp -63.29 86.62 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.455 -160.442 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -131.51 148.74 52.66 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.247 -167.982 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -75.22 129.41 37.42 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.345 172.322 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -98.05 41.87 1.11 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.163 166.581 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -143.55 -40.79 0.3 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.466 -176.949 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.06 -12.61 9.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.332 173.579 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.9 42.45 99.65 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -124.24 136.89 54.49 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 164.332 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 29' ' ' LYS . 2.7 t -61.37 -170.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.242 -169.142 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.655 HD13 ' CB ' ' A' ' 42' ' ' HIS . 12.0 mt -143.1 150.96 40.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.478 -163.671 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -83.05 -171.99 3.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.294 -164.019 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 38' ' ' THR . 97.6 p -64.39 77.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.323 166.12 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 53.96 9.42 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 178.642 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.59 12.93 10.96 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.469 -0.653 . . . . 0.0 111.469 165.791 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.985 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.8 p80 -102.56 -168.79 1.57 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.579 -0.81 . . . . 0.0 110.528 175.933 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.18 158.62 14.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.889 161.304 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.459 ' HB2' ' HH2' ' A' ' 23' ' ' TRP . 2.2 tm-20 -113.13 127.3 56.16 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.982 -163.2 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.533 ' NE2' ' HG3' ' A' ' 46' ' ' GLU . 86.3 t60 -121.48 130.24 53.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.675 160.279 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.533 ' HG3' ' NE2' ' A' ' 45' ' ' HIS . 3.2 mm-40 58.27 34.73 24.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.074 171.698 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 36.65 70.65 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 171.642 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.06 128.2 9.18 Favored Pre-proline 0 C--O 1.242 0.667 0 CA-C-O 121.655 0.741 . . . . 0.0 109.612 162.358 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.477 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 14.6 Cg_endo -63.59 159.9 38.65 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 C-N-CA 122.567 2.178 . . . . 0.0 113.57 174.45 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 72.9 m-85 -151.47 -174.11 4.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.758 165.761 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.8 m -57.63 123.56 16.04 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 113.569 -1.65 . . . . 0.0 110.229 164.362 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -60.73 -28.65 68.84 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.11 -1.404 . . . . 0.0 109.931 165.095 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 22.3 m-70 -155.89 160.27 30.93 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.862 -1.063 . . . . 0.0 108.982 159.255 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -74.57 -20.24 16.26 Favored 'Cis proline' 0 C--N 1.354 0.839 0 C-N-CA 122.803 -1.749 . . . . 0.0 113.699 -11.994 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.599 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 81.9 m -58.91 -56.1 26.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.808 -155.449 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.442 ' CE1' ' HB2' ' A' ' 45' ' ' HIS . 7.0 t80 -61.06 -45.33 95.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.293 -179.772 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.431 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 17.2 t -61.02 -15.4 31.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.547 175.407 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.184 -173.21 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.429 0.511 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.49 133.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.439 169.24 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.7 t -89.58 133.04 35.21 Favored Pre-proline 0 C--O 1.243 0.753 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.166 -165.36 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 6.3 Cg_exo -73.06 -26.78 14.67 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.246 2.631 . . . . 0.0 113.44 171.533 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 -64.41 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.297 -164.712 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -92.5 -28.9 16.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.371 -164.792 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 73.72 58.79 0.09 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.525 -165.832 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.83 -168.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.838 158.245 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -108.82 149.57 28.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.624 160.772 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.935 HG22 ' CD2' ' A' ' 24' ' ' HIS . 65.5 t -103.5 117.89 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.595 -167.662 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -91.88 55.12 2.59 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.951 -156.072 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 61.59 -79.09 0.02 OUTLIER 'General case' 0 C--N 1.34 0.155 0 CA-C-N 113.976 -1.466 . . . . 0.0 110.358 178.477 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.18 -2.12 36.11 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.512 -163.068 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.69 13.96 30.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.251 176.682 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -83.78 153.48 24.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.258 -164.974 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.601 ' CG2' HD22 ' A' ' 28' ' ' LEU . 17.2 m -148.26 122.18 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.741 157.362 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 88.4 m -98.59 135.81 39.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.408 -162.197 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.455 ' OG ' HD22 ' A' ' 19' ' ' LEU . 21.8 t -178.0 137.39 0.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.586 -167.594 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.23 25.92 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.548 -173.039 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.58 -24.2 24.42 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 165.868 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -127.33 139.72 52.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 114.703 -0.749 . . . . 0.0 110.029 -177.251 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -68.86 -179.17 1.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.338 -161.394 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 60.3 m95 -145.77 -177.6 5.67 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 113.59 -1.641 . . . . 0.0 109.396 178.659 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.935 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -100.49 143.73 30.32 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.616 168.83 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 21.7 ttp85 -63.57 -53.22 53.28 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.81 179.13 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.7 Cg_endo -53.25 -13.41 3.22 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 122.459 2.106 . . . . 0.0 113.612 172.296 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -96.38 -64.26 1.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.328 -179.171 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.648 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.8 OUTLIER -64.85 91.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.398 -166.418 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.85 170.68 17.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.234 168.638 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.5 t -60.79 150.62 32.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.326 168.373 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.9 mm-40 -118.74 25.7 10.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.732 160.063 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.47 -59.99 1.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.172 167.902 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -102.3 -48.44 4.19 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.645 -167.759 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.42 56.45 0.51 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 167.284 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -131.01 137.52 49.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.39 167.386 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.4 m -60.73 153.16 24.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.442 174.02 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.5 mt -113.54 153.38 28.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.404 -165.424 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.477 HG22 ' N ' ' A' ' 39' ' ' SER . 93.8 m -68.72 166.58 17.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.475 -178.025 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.477 ' N ' HG22 ' A' ' 38' ' ' THR . 66.4 m -62.4 77.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.415 170.175 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.3 55.2 3.53 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 172.291 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.36 11.53 4.98 Favored Glycine 0 CA--C 1.522 0.519 0 CA-C-N 115.102 -0.549 . . . . 0.0 111.777 166.172 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.648 ' CE1' HD11 ' A' ' 28' ' ' LEU . 3.9 p80 -99.45 -169.26 1.73 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.84 -0.68 . . . . 0.0 110.47 177.49 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -130.91 171.65 12.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.339 168.91 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -147.76 138.35 23.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.05 -170.879 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -121.61 114.79 21.67 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.437 -0.801 . . . . 0.0 108.858 164.797 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.73 -148.11 0.44 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.522 -152.408 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.45 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.35 35.0 4.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 166.923 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm -107.37 87.55 3.36 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 121.211 0.529 . . . . 0.0 109.756 169.229 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.0 Cg_endo -62.85 147.9 94.09 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 122.526 2.151 . . . . 0.0 113.552 -174.847 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.5 m-85 -144.95 -165.78 2.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.922 162.095 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 99.5 m -59.11 -178.01 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.703 171.534 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.84 -32.89 11.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.178 164.586 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.52 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.2 m-70 -164.75 165.97 11.75 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.03 -0.987 . . . . 0.0 109.541 171.472 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.52 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 Cg_endo -69.61 -6.48 9.21 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.635 -1.819 . . . . 0.0 113.604 -11.515 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.5 m -60.28 -51.05 71.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.425 -162.001 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -60.73 -37.42 81.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.416 -168.136 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 60.1 p -86.91 -21.66 26.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.515 -173.817 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.358 -170.232 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.242 0 N-CA-C 113.369 0.488 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 2.1 ttmm 63.77 162.34 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.218 165.331 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.8 t -80.6 131.27 61.6 Favored Pre-proline 0 C--O 1.243 0.737 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.486 -163.256 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.605 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.2 Cg_exo -70.4 -9.11 25.17 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 123.223 2.616 . . . . 0.0 113.504 170.328 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -102.19 -72.55 0.68 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.332 -172.38 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -91.99 -21.85 20.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.524 -160.157 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 t0 73.63 61.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.507 -167.164 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.92 166.65 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.076 159.447 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.532 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -85.4 148.72 25.87 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.42 171.92 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -110.16 116.85 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.742 -160.341 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -168.39 1.17 Allowed 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -74.28 -84.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.509 -165.973 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.78 -10.39 58.2 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.193 -0.603 . . . . 0.0 111.713 -159.158 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -104.98 42.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.963 169.621 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.35 149.12 25.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.396 176.324 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.838 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -148.85 144.71 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.065 162.05 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 m -114.99 135.85 53.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.378 -168.822 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.8 t -177.79 128.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.366 -168.859 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 60.17 22.11 11.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.423 -170.77 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.4 -24.4 27.6 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 164.524 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.4 137.37 51.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 114.76 -0.72 . . . . 0.0 110.24 -177.192 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.67 178.51 5.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.32 -163.388 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.605 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 41.6 m95 -146.46 177.4 9.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.59 -177.311 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -98.21 137.55 36.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.463 169.501 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 10.1 ttp85 -60.8 -47.28 96.22 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.878 -170.702 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.6 Cg_exo -54.75 -35.77 88.71 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.576 2.184 . . . . 0.0 113.544 170.929 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.34 -54.2 13.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.317 -172.967 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HG21 ' A' ' 16' ' ' VAL . 2.1 tp -62.67 96.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.322 -166.243 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -139.82 177.88 7.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 166.863 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.4 t -61.37 170.33 1.83 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.114 164.553 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.576 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 1.8 pt-20 -140.45 20.85 2.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.652 160.08 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.488 ' HE2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -100.2 -57.65 2.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.271 167.577 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.62 -49.83 4.96 Favored 'General case' 0 CA--C 1.524 -0.05 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.525 -170.895 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.05 59.73 0.61 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 169.931 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.68 139.17 27.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.058 0.456 . . . . 0.0 110.457 166.857 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.585 HG22 ' H ' ' A' ' 37' ' ' LEU . 1.8 m -61.49 171.62 1.42 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.437 -173.571 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.703 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.8 mt -129.05 -177.82 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.366 -170.858 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -109.31 -169.44 1.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.548 -170.154 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.5 t -61.32 -25.26 67.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.342 -170.059 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.513 ' H ' HG23 ' A' ' 38' ' ' THR . . . 173.37 70.52 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.79 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.57 10.7 8.53 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.615 -0.594 . . . . 0.0 111.615 166.134 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.703 ' CB ' HD13 ' A' ' 37' ' ' LEU . 6.1 p80 -90.63 -169.5 2.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.441 173.361 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.7 172.59 12.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.328 167.632 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.543 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -128.57 147.76 50.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.964 166.758 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -84.27 -79.37 0.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.837 170.112 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -171.12 73.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.928 167.738 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 155.88 -45.75 0.52 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.545 -174.652 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 2.4 mptp? -143.98 138.61 15.2 Favored Pre-proline 0 C--O 1.242 0.665 0 CA-C-O 121.489 0.661 . . . . 0.0 109.87 -170.927 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.59 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 19.7 Cg_endo -64.18 147.15 91.33 Favored 'Trans proline' 0 N--CA 1.486 1.046 0 C-N-CA 122.658 2.238 . . . . 0.0 113.58 171.012 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.576 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 11.7 m-85 -139.49 -168.12 2.4 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.868 163.814 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 57.3 m -58.42 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.548 166.959 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -102.91 -30.26 10.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.132 161.876 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.3 m-70 -168.46 165.48 7.46 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.412 171.646 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.509 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -70.13 -5.76 9.63 Favored 'Cis proline' 0 N--CA 1.482 0.816 0 C-N-CA 122.576 -1.843 . . . . 0.0 113.741 -10.825 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.6 m -60.07 -41.33 92.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.554 -161.467 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.31 -39.59 94.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.381 -169.335 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -98.65 -19.34 17.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.328 -168.046 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.274 -167.811 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.525 ' H3 ' ' CG ' ' A' ' 22' ' ' ASP . 2.2 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 113.574 0.567 . . . . 0.0 113.574 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 8.4 mmtt -138.87 139.86 38.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.467 -170.38 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.1 t -97.76 122.5 54.79 Favored Pre-proline 0 C--O 1.243 0.711 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.202 -165.329 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 8.3 Cg_endo -61.78 -27.64 80.92 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 122.538 2.159 . . . . 0.0 113.024 172.1 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.521 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.75 -55.43 3.57 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.666 -155.977 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -92.03 -27.61 17.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.395 -177.488 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.95 68.29 0.1 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.504 -165.484 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 -167.69 1.86 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.017 160.394 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.425 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -110.34 149.54 30.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.114 162.419 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.5 t -108.68 130.52 61.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.813 -161.553 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.419 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.8 t80 -90.67 178.43 6.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.359 -178.832 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -64.11 -83.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.281 -167.0 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.8 -1.95 10.74 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.554 -161.872 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -102.77 18.32 21.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.21 178.843 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -98.09 146.51 25.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.276 -165.358 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 28' ' ' LEU . 14.5 m -143.3 120.92 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.891 156.515 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 33.3 m -90.31 132.29 35.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.383 -178.559 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -167.94 124.32 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.155 -162.004 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.666 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.28 24.84 14.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.574 -173.528 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 99.13 -25.43 28.25 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 161.221 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -121.77 138.54 54.33 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.848 -0.676 . . . . 0.0 109.976 178.569 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.525 ' CG ' ' H3 ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -73.06 178.6 4.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.37 -160.489 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 63.3 m95 -143.52 177.5 8.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.802 -176.377 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -102.43 139.48 37.97 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.307 168.056 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.563 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 ttt180 -61.04 -51.27 80.3 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.779 -168.242 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 10.3 Cg_endo -56.82 -28.97 79.31 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.489 2.126 . . . . 0.0 113.518 173.036 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -67.31 -64.64 0.81 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.311 177.511 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -64.57 94.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 -163.444 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.19 173.28 9.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.227 167.516 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -60.63 -178.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.187 166.259 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.531 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -135.01 18.8 3.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.736 160.45 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.6 -45.39 1.48 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.536 -168.096 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -107.12 -32.13 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.75 176.057 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.458 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 85.85 64.39 1.49 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 177.382 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.1 tttp -150.15 145.83 26.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.038 -0.581 . . . . 0.0 110.422 -178.537 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.73 153.31 43.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.461 -174.707 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.494 ' HB2' HD23 ' A' ' 28' ' ' LEU . 14.4 mt -122.06 141.12 51.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.339 -168.179 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.528 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -60.88 -175.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.442 -169.348 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 38' ' ' THR . 11.8 p -67.61 72.55 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.407 169.557 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 18' ' ' SER . . . 72.25 57.72 5.49 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 172.13 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -125.53 12.15 7.47 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 164.315 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.788 ' NE2' HD21 ' A' ' 28' ' ' LEU . 2.8 p80 -102.0 -170.31 1.8 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 114.606 -0.797 . . . . 0.0 110.411 176.104 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.81 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -126.9 -174.35 3.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.34 169.902 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.7 tm-20 -164.94 146.26 7.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.971 -168.664 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -113.73 -51.34 2.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.755 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -171.15 99.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.101 165.9 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.25 12.66 32.35 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.649 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG2' ' HG3' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -141.8 86.99 10.27 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 114.914 -0.643 . . . . 0.0 109.785 -175.632 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.494 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.1 Cg_endo -60.94 147.26 96.13 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.518 2.145 . . . . 0.0 113.608 -176.198 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 4.3 m-85 -135.51 -178.55 5.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.015 164.464 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.9 m -59.31 -178.42 0.06 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.652 172.331 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.81 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 1.1 m-20 -97.37 -34.88 10.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.999 164.481 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.0 m-70 -154.73 173.94 4.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-O 122.135 0.969 . . . . 0.0 109.344 165.969 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.6 Cg_endo -62.29 -12.93 3.62 Favored 'Cis proline' 0 N--CA 1.498 1.743 0 C-N-CA 121.312 -2.37 . . . . 0.0 112.505 -20.699 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.4 m -58.15 -48.3 80.69 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.85 -158.628 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.76 -41.02 94.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.457 -168.81 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -77.76 -18.92 55.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.55 -176.911 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.215 -168.161 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.083 0 N-CA-C 113.418 0.507 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -148.23 165.51 30.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.388 -168.363 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.7 t -78.93 135.83 58.68 Favored Pre-proline 0 C--O 1.244 0.803 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.434 -162.489 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.6 Cg_exo -69.85 -26.39 27.19 Favored 'Trans proline' 0 N--CA 1.484 0.966 0 C-N-CA 123.437 2.758 . . . . 0.0 113.358 166.826 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.401 ' HE3' ' NZ ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -85.97 -65.85 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.365 -167.296 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -97.4 -25.84 15.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.577 -163.965 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.7 t70 72.77 69.7 0.13 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.504 -164.544 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 0.2 OUTLIER -129.6 -168.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.158 163.22 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.69 148.37 28.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.406 160.851 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.4 t -107.71 112.45 40.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.902 -165.919 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CZ ' ' A' ' 12' ' ' PHE . 17.7 t80 -66.95 160.91 25.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.354 176.342 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CZ ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -62.24 -76.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.221 -167.868 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.76 -0.31 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.45 -162.553 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -105.7 16.59 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.279 177.064 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.56 157.8 16.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.263 -166.148 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.549 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.89 123.09 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.82 160.393 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 84.9 m -100.62 135.28 42.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.443 -167.259 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.459 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 6.9 t -177.91 130.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.438 -166.061 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.4 mm? 60.04 37.69 21.03 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.663 -175.158 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.22 17.61 46.38 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 165.709 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -151.33 123.15 8.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.039 168.019 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 6.7 m-20 -63.56 -179.34 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.351 -162.703 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 50.4 m95 -145.79 169.68 18.04 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.708 -178.077 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -92.85 144.02 25.69 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.52 170.245 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.542 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 ttp85 -61.16 -49.51 88.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 -169.833 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 2.9 Cg_exo -57.8 -33.68 97.23 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.692 2.261 . . . . 0.0 113.504 172.728 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.17 -55.81 8.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.28 -171.194 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.688 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.9 tp -60.7 87.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.345 -167.054 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.401 ' NZ ' ' HE3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -129.08 153.39 47.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.224 -170.874 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -65.6 171.38 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.441 164.688 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.537 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 38.6 tt0 -121.54 -21.64 6.16 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.707 173.322 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -94.7 -39.42 10.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.501 -167.53 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.9 p -105.98 -42.49 5.1 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.0 174.701 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.462 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 86.41 58.04 2.01 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 175.601 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.28 139.2 49.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.364 167.792 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 158.27 18.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.32 -176.645 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.6 mt -119.96 137.04 54.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.434 -166.235 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 39' ' ' SER . 39.4 m -67.61 169.76 8.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.523 -178.571 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG22 ' A' ' 38' ' ' THR . 2.3 m -69.55 76.67 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.436 -175.27 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.28 56.64 1.44 Allowed Glycine 0 CA--C 1.529 0.918 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 169.633 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.8 10.72 3.68 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-N 114.908 -0.646 . . . . 0.0 111.824 166.972 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.688 ' CE1' HD11 ' A' ' 28' ' ' LEU . 2.8 p80 -103.54 -170.45 1.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.328 -177.102 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.847 ' HB2' ' ND2' ' A' ' 52' ' ' ASN . . . -132.51 -171.72 2.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.061 165.19 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -170.98 154.49 4.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.972 -172.624 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 14.4 p80 -105.86 -169.3 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.067 160.006 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -62.53 81.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.272 -177.424 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 124.18 -33.8 3.73 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 168.651 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.9 OUTLIER -124.51 109.1 28.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-O 121.574 0.702 . . . . 0.0 109.735 -165.199 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.5 Cg_endo -63.7 148.41 92.16 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.651 2.234 . . . . 0.0 113.642 173.122 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 5.1 m-85 -135.44 -168.03 2.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.815 165.684 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 52.8 m -58.45 -169.45 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.974 -1.467 . . . . 0.0 110.489 164.184 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.847 ' ND2' ' HB2' ' A' ' 43' ' ' ALA . 0.4 OUTLIER -100.77 -37.67 8.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.23 163.046 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 35.4 m-70 -157.79 172.8 5.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-O 122.195 0.998 . . . . 0.0 109.456 167.154 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 27.0 Cg_endo -63.59 -11.53 4.19 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.486 -2.297 . . . . 0.0 112.516 -19.081 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 58.6 m -58.27 -40.57 82.22 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.71 -158.615 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -61.12 -30.99 70.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.276 -172.714 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.3 t -108.26 24.16 13.43 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.488 176.468 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.165 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.246 -175.28 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.636 0.591 . . . . 0.0 113.636 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.94 168.31 20.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.413 177.941 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 12.6 t -77.53 130.93 72.59 Favored Pre-proline 0 C--O 1.246 0.869 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.554 -163.092 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.636 ' HG3' ' HG3' ' A' ' 21' ' ' LYS . 4.1 Cg_exo -68.91 -14.82 39.47 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 C-N-CA 123.23 2.62 . . . . 0.0 113.397 168.679 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.56 ' HE2' ' HD2' ' A' ' 49' ' ' PRO . 8.9 tptp -95.68 -72.36 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.235 -169.545 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -91.74 -23.17 19.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.568 -163.098 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 74.12 55.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 -167.621 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.27 176.91 6.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.699 155.915 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.85 151.26 19.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.783 171.997 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 70.5 t -113.25 111.05 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.852 -163.535 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.33 -167.99 1.04 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.405 -173.779 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -62.56 -83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.203 -164.934 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.58 -15.41 59.25 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.609 -163.233 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -95.87 41.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.98 174.348 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.4 140.88 47.69 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.598 170.781 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 134.32 61.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.838 159.285 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -103.01 139.06 39.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.422 -169.039 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.485 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 3.6 t -177.63 122.55 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.193 -165.965 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.685 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.23 32.6 20.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.506 -171.218 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.42 61.69 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 164.163 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -145.15 125.52 13.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 164.204 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.444 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -66.94 179.81 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.411 -161.028 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.1 m95 -148.34 175.81 10.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 114.205 -1.361 . . . . 0.0 109.724 -176.916 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -95.35 150.26 20.46 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.563 172.24 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.442 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.09 86.12 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.873 -167.594 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -65.51 -36.19 35.28 Favored 'Trans proline' 0 N--CA 1.483 0.89 0 C-N-CA 122.696 2.264 . . . . 0.0 113.526 176.267 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.2 -47.12 87.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.201 -165.174 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.959 HD21 ' NE2' ' A' ' 42' ' ' HIS . 5.0 tp -59.96 92.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.402 -159.774 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.559 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -132.29 165.11 24.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.252 -171.257 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.9 t -61.4 179.39 0.22 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.307 172.333 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.487 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 2.6 tp10 -143.93 22.99 1.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.967 162.605 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.449 ' HG2' ' HE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -128.79 -37.23 1.76 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.719 -171.426 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.4 p -106.97 -48.3 3.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.483 165.938 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.99 58.32 0.88 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -169.648 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.6 141.39 46.61 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.966 -0.617 . . . . 0.0 110.459 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.559 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -74.66 152.67 39.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.405 -170.455 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.52 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 22.9 mt -117.87 161.13 20.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.336 -168.529 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -103.99 -175.01 2.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.367 -167.511 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 1.5 p -61.04 -18.68 59.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.383 -167.823 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.69 68.32 0.03 OUTLIER Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 169.548 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.08 10.55 5.93 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 167.356 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.959 ' NE2' HD21 ' A' ' 28' ' ' LEU . 3.8 p80 -93.0 -169.74 2.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.415 176.793 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -131.66 -168.79 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.142 168.286 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.519 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -166.67 160.61 15.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.049 168.144 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.46 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 85.5 t60 -132.44 72.06 1.49 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.96 -177.335 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 58.4 87.17 0.08 Allowed 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.918 -179.603 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.81 -21.27 46.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 165.086 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -132.51 96.38 19.01 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.669 0.747 . . . . 0.0 109.866 -167.991 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.56 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 16.1 Cg_endo -59.49 142.67 99.29 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 122.256 1.97 . . . . 0.0 113.627 175.752 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 73.6 m-85 -135.72 -177.1 4.52 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.017 176.461 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 65.4 m -58.98 -178.21 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.526 168.344 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.78 -27.95 14.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.018 160.976 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 51.8 m-70 -169.52 166.53 5.78 Favored Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.497 172.119 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.522 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 Cg_endo -69.16 -6.75 8.6 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.574 -1.844 . . . . 0.0 113.673 -12.071 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HA ' ' HB2' ' A' ' 58' ' ' ALA . 66.4 m -60.52 -49.56 77.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.401 -162.727 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.92 -38.07 84.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.418 -171.455 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -106.07 32.91 4.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.496 170.208 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.517 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.284 169.742 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.479 0.53 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HD2' ' CG ' ' A' ' 9' ' ' GLU . 1.7 mmtp 63.71 156.68 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.343 170.614 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.4 t -80.46 132.33 59.04 Favored Pre-proline 0 C--O 1.244 0.787 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.408 -162.006 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.0 Cg_exo -69.06 -19.78 38.99 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 123.267 2.644 . . . . 0.0 113.312 167.128 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -70.86 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.353 -166.304 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -91.19 -24.07 20.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 -165.142 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 73.45 58.3 0.1 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.534 -167.48 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.5 -168.88 1.56 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.891 158.904 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.406 ' CG ' ' HD2' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -109.76 152.09 26.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.574 160.219 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -107.59 110.33 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.746 -163.845 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -74.43 178.23 5.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.151 -179.63 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -61.4 -84.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.567 -165.071 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -6.49 35.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.861 -158.802 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 17.71 11.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.287 -176.858 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.441 ' H ' ' HD2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -85.2 154.29 22.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.246 -163.971 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 28' ' ' LEU . 11.4 m -148.31 121.88 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.254 161.025 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.7 m -102.5 135.4 44.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.389 -163.921 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.496 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 17.7 t -177.99 132.55 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.408 -166.625 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.1 34.68 21.27 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.65 -177.276 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.47 18.17 50.03 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 167.268 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -150.34 125.08 9.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.053 166.703 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.86 -179.77 0.3 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.448 -162.592 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.4 m95 -145.91 -172.14 3.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.066 -1.425 . . . . 0.0 109.446 179.773 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -103.16 148.86 25.24 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.544 169.39 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.566 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 30.4 ttt180 -65.56 -50.36 56.96 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.79 -174.225 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.2 Cg_endo -57.31 -22.81 51.27 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 122.531 2.154 . . . . 0.0 113.542 174.152 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -84.16 -57.91 2.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.299 -170.757 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.805 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -60.79 93.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.456 -166.461 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.5 mtpm? -148.89 150.8 33.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 -174.912 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -66.54 136.08 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.198 161.896 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -115.22 33.41 5.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.044 167.559 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -46.82 3.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.679 167.676 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.3 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.85 179.982 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.52 51.61 3.82 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.456 -1.057 . . . . 0.0 110.456 169.063 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -128.39 128.38 44.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.109 -0.546 . . . . 0.0 110.405 -176.268 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.469 ' HA ' ' CG ' ' A' ' 29' ' ' LYS . 55.8 m -60.98 139.22 58.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.298 168.563 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 13.5 mt -104.8 166.72 10.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.394 -166.359 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.558 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -94.2 -172.01 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.37 -167.935 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.558 ' H ' HG22 ' A' ' 38' ' ' THR . 6.9 p -61.02 -18.35 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.368 -168.141 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.61 0.02 OUTLIER Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 169.05 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.37 10.58 9.9 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 165.938 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.805 ' CE1' HD11 ' A' ' 28' ' ' LEU . 7.3 p80 -94.57 -169.91 2.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.422 177.614 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.716 ' HB2' ' ND2' ' A' ' 52' ' ' ASN . . . -137.61 -164.25 1.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.167 168.634 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -160.18 148.34 16.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.231 174.329 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -128.0 70.32 1.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.884 -166.642 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 58.36 89.64 0.05 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.898 -178.473 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.75 -28.86 12.54 Favored Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 164.847 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -141.98 137.42 15.94 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 121.439 0.637 . . . . 0.0 109.779 -173.553 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.9 Cg_endo -63.57 150.83 87.53 Favored 'Trans proline' 0 N--CA 1.486 1.05 0 C-N-CA 122.649 2.233 . . . . 0.0 113.505 169.067 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 86.1 m-85 -141.05 -164.9 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.949 162.799 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 13.5 m -57.43 -177.52 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.641 167.602 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.716 ' ND2' ' HB2' ' A' ' 43' ' ' ALA . 0.3 OUTLIER -100.38 -26.12 13.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.844 158.351 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 50.6 m-70 -170.82 166.22 4.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 CA-C-N 114.645 -1.162 . . . . 0.0 109.343 172.178 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 8.2 Cg_endo -71.08 -7.84 12.62 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.656 -1.81 . . . . 0.0 113.604 -12.279 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.8 m -60.06 -32.42 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.534 -160.87 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -77.19 -36.08 55.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.334 -172.538 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 19.6 m -93.55 24.04 4.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.467 169.813 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.478 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.245 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.345 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.441 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 3.7 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 N-CA-C 113.513 0.543 . . . . 0.0 113.513 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.84 143.48 0.74 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.271 -168.541 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.1 t -80.79 131.08 61.5 Favored Pre-proline 0 C--O 1.245 0.85 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.399 -162.361 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 5.3 Cg_exo -68.56 -15.85 41.95 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 123.277 2.651 . . . . 0.0 113.372 168.39 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.37 -71.41 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.384 -167.743 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.6 p -91.53 -23.02 20.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.474 -162.249 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 t0 73.71 57.34 0.1 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.535 -166.444 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 174.68 8.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.971 158.556 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.14 150.5 20.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.701 168.205 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 55.6 t -111.4 113.63 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.829 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 12' ' ' PHE . 60.7 t80 -66.11 170.06 6.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.421 177.278 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.493 ' N ' ' CD2' ' A' ' 11' ' ' TYR . 38.3 m-85 -61.89 -82.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.515 -169.347 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.74 -10.96 60.37 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.758 -162.598 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -103.8 44.49 1.02 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.06 168.848 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -109.7 151.49 26.84 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.444 171.117 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.468 HG21 HD22 ' A' ' 28' ' ' LEU . 17.5 m -136.66 147.54 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.863 160.165 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 m -116.22 135.31 54.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.443 -166.783 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.459 ' C ' HD22 ' A' ' 19' ' ' LEU . 13.7 t -178.17 123.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -171.156 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.26 32.42 20.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.423 -171.029 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.28 18.72 65.52 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 162.883 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.55 128.26 19.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 166.377 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.46 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -69.77 177.75 2.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.367 -164.286 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.7 m95 -146.49 178.22 8.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.614 -176.253 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.7 m80 -98.79 140.22 33.3 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 114.075 -1.421 . . . . 0.0 110.494 169.035 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.588 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.38 -46.67 94.87 Favored Pre-proline 0 CA--C 1.544 0.73 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.848 -172.103 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 11.8 Cg_exo -48.78 -37.26 35.27 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.713 2.275 . . . . 0.0 113.486 167.781 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.45 -58.79 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.359 -165.389 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.808 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.0 tp -60.54 89.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.368 -164.575 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 mtmt -128.99 177.03 7.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.112 168.482 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.9 t -59.82 166.6 2.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.401 169.057 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -131.33 25.51 4.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.766 162.006 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tppm? -114.19 -63.59 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.324 169.147 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -92.05 -42.02 10.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.493 -165.333 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.2 62.5 0.81 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 -171.128 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -132.87 144.9 50.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.469 173.972 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.97 143.68 50.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.497 170.053 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HB3' ' CG ' ' A' ' 42' ' ' HIS . 88.0 mt -109.08 -168.22 1.31 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.437 -169.412 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.8 170.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.249 -167.385 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.01 18.5 11.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.423 -175.716 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.62 50.61 0.06 OUTLIER Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 162.8 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 58.34 54.1 40.41 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 156.515 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.808 ' NE2' HD21 ' A' ' 28' ' ' LEU . 15.7 p80 -60.43 -170.7 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.029 -0.585 . . . . 0.0 110.586 178.25 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB1' ' CE1' ' A' ' 56' ' ' TYR . . . -135.63 175.69 9.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.404 -177.672 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -160.49 141.49 11.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.068 166.117 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.495 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 2.8 m80 -88.79 -42.16 12.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.388 -166.695 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.49 47.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.043 -171.31 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 21.59 53.59 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 -177.473 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -141.18 96.04 7.28 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.852 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.2 Cg_endo -62.97 144.49 93.19 Favored 'Trans proline' 0 N--CA 1.485 0.99 0 C-N-CA 122.714 2.276 . . . . 0.0 113.66 -170.217 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.3 m-85 -126.62 -174.12 3.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 169.969 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 64.3 m -59.2 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.123 -1.398 . . . . 0.0 110.511 169.297 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -110.47 -32.68 6.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.74 158.404 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 11.5 m-70 -145.23 175.01 2.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.365 162.647 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.7 Cg_endo -59.76 -15.66 2.49 Favored 'Cis proline' 0 N--CA 1.5 1.868 0 C-N-CA 120.651 -2.645 . . . . 0.0 112.331 -25.354 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.8 m -59.14 -50.61 73.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.798 -160.278 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.591 ' CE1' ' HB1' ' A' ' 43' ' ' ALA . 11.0 t80 -69.14 -41.21 77.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.462 -172.139 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.9 t -68.9 -21.35 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.415 179.785 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.29 -171.684 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.416 ' HA ' ' OD1' ' A' ' 22' ' ' ASP . 10.1 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -61.01 146.93 45.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.344 -167.402 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.543 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 22.9 t -79.93 129.36 70.77 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.383 -163.86 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.3 Cg_endo -67.88 -18.65 46.93 Favored 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 123.25 2.634 . . . . 0.0 113.497 169.088 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -68.61 0.78 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.251 -166.335 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -94.77 -24.42 17.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.479 -163.358 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t70 73.65 65.88 0.09 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.47 -165.767 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -129.04 -168.47 1.93 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.927 159.573 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.42 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -107.49 147.08 30.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.207 163.52 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.931 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.3 t -105.59 116.47 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.767 -163.741 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -166.85 0.65 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.289 -178.889 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.91 -83.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.48 -167.67 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.83 -12.47 61.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.726 -159.081 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -94.44 17.13 13.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.199 179.894 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.1 ptt-85 -88.53 149.24 23.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.329 -168.249 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 m -148.25 119.54 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.067 161.66 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 42.9 m -93.03 137.16 32.63 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.397 -174.792 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.488 ' C ' HD22 ' A' ' 19' ' ' LEU . 2.0 t -174.33 129.68 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.276 -168.815 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.641 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.98 31.85 20.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.571 -171.781 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.6 61.91 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 166.272 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -147.29 122.57 10.26 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 164.553 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -63.25 -179.82 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.381 -162.011 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.6 m95 -145.78 178.25 8.3 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.742 -178.015 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.931 ' CD2' HG22 ' A' ' 10' ' ' VAL . 48.2 m80 -98.24 146.53 25.54 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.202 -1.363 . . . . 0.0 110.51 171.055 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 tpt180 -62.04 -47.36 90.96 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.719 -171.949 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -62.85 -28.34 75.62 Favored 'Trans proline' 0 N--CA 1.484 0.961 0 C-N-CA 122.491 2.127 . . . . 0.0 113.531 176.915 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.23 -49.43 19.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.136 -165.743 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.825 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -73.03 94.55 1.9 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.341 -160.449 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.34 170.04 15.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.075 163.719 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -60.06 -174.89 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.318 172.144 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -144.65 22.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.65 157.327 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.02 -33.04 1.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.553 -165.106 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.5 p -110.7 -53.01 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.504 163.999 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.24 68.23 0.61 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -169.114 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -144.18 162.69 35.68 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.449 -178.778 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.07 156.49 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.424 169.88 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' A' ' 42' ' ' HIS . 5.8 mt -129.53 173.84 10.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.261 -166.851 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.21 -162.43 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.351 -160.394 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 2.9 p -61.08 -85.44 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.424 -177.863 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.33 48.36 1.03 Allowed Glycine 0 CA--C 1.539 1.543 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 159.498 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.82 -105.85 0.01 OUTLIER Glycine 0 CA--C 1.533 1.162 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 152.443 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.886 ' HB3' HD22 ' A' ' 37' ' ' LEU . 4.3 p80 -58.74 -170.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.862 -0.669 . . . . 0.0 110.806 -163.675 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.579 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -125.55 -166.9 1.61 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.96 160.965 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.498 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -135.73 146.44 47.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.071 -176.31 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.423 ' CD2' ' HB2' ' A' ' 46' ' ' GLU . 85.6 t60 -147.48 112.1 5.32 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.759 178.589 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.423 ' HB2' ' CD2' ' A' ' 45' ' ' HIS . 0.7 OUTLIER 58.65 43.1 19.42 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.603 167.739 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.92 46.13 18.24 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 165.629 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 pttt 176.26 97.3 0.1 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -178.184 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.8 144.08 96.62 Favored 'Trans proline' 0 N--CA 1.484 0.955 0 C-N-CA 122.936 2.424 . . . . 0.0 113.555 -167.562 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.9 OUTLIER -131.55 171.18 13.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.728 161.973 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 55.8 m -58.62 145.45 39.6 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 113.836 -1.529 . . . . 0.0 110.81 174.646 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.25 -34.92 75.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.383 -1.28 . . . . 0.0 110.369 175.291 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.1 m-70 -163.07 165.22 15.04 Favored Pre-proline 0 CA--C 1.549 0.909 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.529 166.729 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -69.89 -6.08 9.43 Favored 'Cis proline' 0 N--CA 1.483 0.881 0 C-N-CA 122.594 -1.836 . . . . 0.0 113.689 -11.523 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 93.2 m -60.37 -50.37 73.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.577 -161.693 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -62.03 -37.86 86.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.351 -172.307 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.438 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -107.24 29.28 7.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.474 175.751 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.365 171.212 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.484 0.955 0 N-CA-C 113.494 0.536 . . . . 0.0 113.494 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 15.3 tttt 65.2 153.58 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.47 165.903 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 15.1 t -72.41 128.61 88.47 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.584 -166.663 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 3.7 Cg_exo -69.99 -7.86 22.17 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.363 2.708 . . . . 0.0 113.39 168.946 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -70.86 0.71 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.276 -173.648 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -97.03 -21.73 17.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.656 -161.152 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t0 73.75 62.98 0.09 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.529 -167.897 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -140.06 166.71 23.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.895 158.947 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.499 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -85.23 152.39 23.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.836 179.609 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' NE2' ' A' ' 24' ' ' HIS . 98.8 t -124.65 125.36 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.334 -164.013 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 12' ' ' PHE . 9.7 t80 -172.23 136.79 0.85 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -159.64 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 11' ' ' TYR . 2.2 m-85 70.64 178.12 0.26 Allowed 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -162.677 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.27 -0.5 10.11 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.584 -155.443 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.31 -18.92 52.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.41 171.081 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.714 ' CB ' HG12 ' A' ' 10' ' ' VAL . 9.8 ptm180 -87.03 127.64 35.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.307 -168.432 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.3 m -127.85 171.33 16.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.091 166.18 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -127.31 137.62 52.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.452 -167.585 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 10.1 t -176.05 126.65 0.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.315 -175.746 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.679 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.22 24.59 13.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.473 -171.622 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.37 -24.76 25.89 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 162.908 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 1.5 mptp? -113.45 132.17 55.75 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.23 -178.263 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 9.1 m-20 -70.47 179.35 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.32 -163.246 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.63 164.8 34.17 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.732 -176.923 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.932 ' NE2' HG22 ' A' ' 10' ' ' VAL . 35.9 m80 -85.35 137.06 33.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.481 164.412 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 3.9 tpm_? -61.21 -49.45 88.16 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.817 -172.651 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.57 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.9 Cg_endo -58.58 -16.7 31.3 Favored 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 122.568 2.179 . . . . 0.0 113.569 174.234 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.88 -49.41 7.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.298 -177.223 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.852 HD21 ' NE2' ' A' ' 42' ' ' HIS . 1.7 tp -62.92 86.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.378 -167.226 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 11.9 mtmt -133.86 163.8 28.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.359 -178.159 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -64.53 157.78 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 168.157 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -126.31 24.91 6.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.997 164.366 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HE2' ' HB2' ' A' ' 58' ' ' ALA . 3.6 tttp -109.29 -64.15 1.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.198 163.01 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -92.8 -19.08 22.1 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.517 -165.084 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.91 53.4 3.53 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 167.554 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -143.93 147.52 34.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.058 -0.571 . . . . 0.0 110.433 179.796 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -61.49 171.64 1.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.508 176.54 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.3 mt -133.14 176.58 8.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.285 -177.498 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -111.03 -174.68 2.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.376 -165.804 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.615 ' H ' HG22 ' A' ' 38' ' ' THR . 29.8 t -61.11 -15.5 33.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.437 -170.02 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.56 67.16 0.03 OUTLIER Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 167.519 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -122.62 11.77 8.92 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 165.775 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.852 ' NE2' HD21 ' A' ' 28' ' ' LEU . 4.6 p80 -97.2 -169.19 1.82 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.876 -0.662 . . . . 0.0 110.369 174.754 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.98 -165.64 2.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.246 166.32 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.434 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 20.3 tt0 -158.32 151.16 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.997 -174.821 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.408 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 8.4 p80 -93.19 16.26 13.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.562 171.216 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 58.7 72.95 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.675 -169.585 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 167.64 -41.98 0.24 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -179.634 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.85 134.3 4.31 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-O 121.494 0.664 . . . . 0.0 109.652 169.65 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 18.9 Cg_endo -60.62 145.46 98.8 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 C-N-CA 122.42 2.08 . . . . 0.0 113.625 -178.413 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 3.0 m-85 -133.53 -164.81 1.54 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.76 162.268 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 60.1 m -59.09 -171.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.418 167.794 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -99.86 -31.85 11.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.12 163.186 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 49.6 m-70 -168.23 165.3 7.84 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.542 171.652 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.512 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.3 Cg_endo -70.44 -5.58 10.01 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.637 -1.818 . . . . 0.0 113.672 -10.789 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 65.0 m -60.07 -39.75 87.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.494 -161.412 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -67.95 -36.75 80.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.426 -170.957 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.9 p -100.25 21.04 13.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.434 174.768 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.534 ' HB2' ' HE2' ' A' ' 32' ' ' LYS . . . . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.425 172.12 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.486 1.061 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.582 ' HG2' ' HB3' ' A' ' 9' ' ' GLU . 16.5 mtpt 61.94 167.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.379 168.837 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.5 t -80.28 127.36 76.61 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.457 -164.224 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -67.07 -13.86 41.34 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 123.228 2.619 . . . . 0.0 113.465 167.447 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.45 -73.11 0.59 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.41 -172.245 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -91.44 -13.42 32.33 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.479 -168.202 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.11 56.96 3.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.655 -167.99 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 2.5 tttt -110.17 -167.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.965 158.925 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.582 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -107.86 149.57 28.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.263 162.863 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.93 HG22 ' CD2' ' A' ' 24' ' ' HIS . 66.1 t -111.13 113.84 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.921 -166.9 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.07 -168.61 1.32 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.365 175.78 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -72.43 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.451 -165.446 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.77 -1.14 8.41 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.036 -0.666 . . . . 0.0 111.62 -161.076 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.4 17.53 23.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.386 178.348 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 151.97 19.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.311 -165.079 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.813 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.98 145.37 18.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.916 160.151 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 28.2 m -118.9 134.83 54.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -167.56 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 20.7 t -178.18 131.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.316 -169.87 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.1 mm? 60.19 20.65 10.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.454 -169.435 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.68 -24.39 28.2 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 165.438 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.39 141.66 45.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.843 -0.678 . . . . 0.0 110.224 -177.593 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.4 177.01 9.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.394 -164.562 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.6 m95 -146.95 179.67 7.44 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.665 -176.181 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.93 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.4 m80 -100.07 136.56 39.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.468 165.424 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HD3' HG11 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -67.77 -47.09 44.8 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.85 -172.121 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -47.72 -38.71 29.89 Favored 'Trans proline' 0 N--CA 1.485 1.006 0 C-N-CA 122.711 2.274 . . . . 0.0 113.46 166.525 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -68.05 -56.41 8.99 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.255 -178.393 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.98 HD21 ' CD2' ' A' ' 42' ' ' HIS . 5.7 tp -60.46 89.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.37 -163.768 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.0 pttt -132.4 160.01 37.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.36 171.773 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.2 t -60.74 158.69 12.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.276 167.239 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 23.5 pt-20 -134.44 23.55 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.577 159.043 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -36.62 5.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.505 -179.764 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.6 -52.62 2.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.463 164.838 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 114.56 57.86 0.37 Allowed Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 172.027 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -136.82 143.1 42.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.412 168.836 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -61.77 157.59 17.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.475 175.206 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.81 HD13 ' HB2' ' A' ' 42' ' ' HIS . 6.6 mt -116.19 -173.09 2.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.342 -171.013 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.31 -176.72 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.341 -167.363 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 28.2 p -61.58 -21.39 64.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.387 -168.513 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.04 53.63 0.06 OUTLIER Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.728 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.49 10.58 14.44 Favored Glycine 0 CA--C 1.522 0.475 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 167.099 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.98 ' CD2' HD21 ' A' ' 28' ' ' LEU . 6.7 p80 -86.57 -170.0 2.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.231 -0.485 . . . . 0.0 110.386 174.629 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -154.45 -168.97 3.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.142 166.687 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.7 152.88 3.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.947 -168.45 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -130.87 73.52 1.55 Allowed 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.97 179.731 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.48 83.63 0.12 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.916 -176.465 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.36 45.93 66.52 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 167.397 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.34 90.11 0.51 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.538 0.685 . . . . 0.0 109.845 169.838 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.89 145.25 99.32 Favored 'Trans proline' 0 N--CA 1.485 1.023 0 C-N-CA 122.514 2.143 . . . . 0.0 113.691 -178.318 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 54.1 m-85 -144.48 -159.8 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.906 167.888 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 36.4 m -55.39 179.61 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.26 170.886 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -105.15 -29.42 10.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.605 157.66 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.38 166.14 16.84 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.276 164.923 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -69.83 -14.69 12.63 Favored 'Cis proline' 0 N--CA 1.482 0.81 0 C-N-CA 122.41 -1.912 . . . . 0.0 113.654 -13.629 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.7 m -59.85 -49.56 77.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.511 -160.032 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.84 -48.73 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.265 -170.812 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.492 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 6.8 m -72.89 -18.74 61.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.383 -174.471 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.264 -170.289 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.613 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 21.7 Cg_exo . . . . . 0 N--CA 1.485 0.982 0 N-CA-C 113.569 0.565 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER 66.12 125.84 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.672 165.605 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 21.7 t -93.96 120.83 65.36 Favored Pre-proline 0 C--O 1.245 0.829 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.575 -168.44 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.596 ' HD2' ' CD2' ' A' ' 23' ' ' TRP . 4.3 Cg_exo -75.97 -5.66 16.58 Favored 'Trans proline' 0 N--CA 1.483 0.856 0 C-N-CA 123.201 2.601 . . . . 0.0 113.818 173.628 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.527 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.94 -78.65 0.38 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.573 -179.719 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -77.04 -23.21 52.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.501 -173.016 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 71.89 47.7 0.31 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.475 -173.762 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.7 -168.91 1.61 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.829 159.277 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -108.67 154.65 21.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.708 160.975 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.1 t -114.94 115.36 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.403 -162.894 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -92.17 55.09 2.5 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.852 -156.942 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 67.54 -79.99 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.594 173.668 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.07 0.11 25.91 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.383 -162.48 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -107.0 12.69 28.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.254 175.954 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.05 26.06 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.271 -163.083 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.647 ' CG2' HD22 ' A' ' 28' ' ' LEU . 15.8 m -148.27 121.89 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.843 158.265 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 90.1 m -97.48 136.72 37.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.414 -161.659 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' HD22 ' A' ' 19' ' ' LEU . 23.0 t -178.2 137.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.428 -167.799 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.613 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 60.04 22.11 11.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.625 -171.248 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.05 -23.14 22.31 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 168.797 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 21' ' ' LYS . 14.8 mmmt -122.31 126.73 48.72 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.739 -0.731 . . . . 0.0 110.021 -176.634 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.613 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -60.43 -175.47 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.365 -160.995 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.596 ' CD2' ' HD2' ' A' ' 4' ' ' PRO . 72.5 m95 -146.49 -172.79 4.03 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 112.892 -1.958 . . . . 0.0 109.501 179.127 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.0 m80 -100.75 153.01 19.81 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.612 165.211 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -69.22 -63.85 1.89 Allowed Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.788 179.943 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -50.84 -17.56 3.37 Favored 'Trans proline' 0 N--CA 1.485 1.013 0 C-N-CA 122.301 2.001 . . . . 0.0 113.455 177.337 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -80.99 -52.89 6.94 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.394 178.692 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.902 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.9 tp -72.98 82.84 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.319 -163.952 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -138.45 172.07 13.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.304 167.931 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -67.97 157.68 34.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.357 174.297 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.36 23.67 5.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.749 161.399 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.417 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -116.95 -41.36 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.471 -171.45 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -110.98 -52.44 2.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.782 173.264 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.05 59.01 0.25 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 173.076 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.0 mtpp -149.07 168.28 23.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.408 -177.568 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' LEU . 8.0 m -92.87 168.05 11.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.381 -178.78 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.745 HD13 ' CB ' ' A' ' 42' ' ' HIS . 4.1 mt -131.65 131.45 43.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.419 -167.563 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -155.91 -170.15 3.31 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.232 173.014 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.507 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER 63.42 14.74 8.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.026 -163.45 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.31 45.89 95.3 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 -162.734 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -94.13 9.9 72.13 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 -163.385 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.902 ' CE1' HD11 ' A' ' 28' ' ' LEU . 3.5 p80 -106.32 -171.6 1.93 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.142 0.496 . . . . 0.0 110.545 -173.656 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -176.37 159.63 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.134 175.74 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.423 ' HG2' HD11 ' A' ' 19' ' ' LEU . 1.1 pt-20 -109.47 140.7 42.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.961 -165.134 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -94.41 41.22 1.09 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.797 1.284 . . . . 0.0 109.506 161.89 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.5 98.78 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.622 -171.833 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.22 37.22 43.03 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 168.4 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mttt 179.95 96.31 0.19 Allowed Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.238 0.542 . . . . 0.0 109.724 172.892 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -63.52 146.5 92.94 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 C-N-CA 122.754 2.302 . . . . 0.0 113.546 -173.521 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -145.13 -162.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.938 166.411 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.7 m -57.52 179.45 0.06 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.724 167.925 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.54 -27.56 12.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.066 161.426 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.535 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 44.8 m-70 -164.83 166.99 10.47 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.464 170.178 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.674 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 11.5 Cg_endo -68.69 -7.94 8.47 Favored 'Cis proline' 0 N--CA 1.482 0.834 0 C-N-CA 122.513 -1.87 . . . . 0.0 113.702 -12.693 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.1 m -60.48 -52.71 64.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.417 -162.461 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -60.72 -33.37 72.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.394 -168.366 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.507 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.9 OUTLIER -112.08 26.78 10.26 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.322 179.97 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.323 178.783 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 11.9 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 160.89 30.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.406 -168.57 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.2 t -81.15 130.82 61.29 Favored Pre-proline 0 C--O 1.246 0.872 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.461 -162.689 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -69.08 -18.13 40.33 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 123.379 2.719 . . . . 0.0 113.368 166.908 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 -70.9 0.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.381 -167.301 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.1 p -91.65 -24.17 19.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.432 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 73.03 54.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.505 -167.609 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 4.2 tptp -112.64 -169.27 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.822 158.409 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -109.52 150.97 27.37 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.526 161.386 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -107.74 114.9 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.63 -165.439 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -101.36 56.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.023 0.915 . . . . 0.0 110.079 -158.906 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.27 -80.59 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.354 170.8 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.02 -6.37 56.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.414 -157.615 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -114.09 41.66 2.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.082 163.502 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -86.45 149.16 25.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.367 177.758 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.429 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -147.12 122.4 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.623 158.392 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.6 m -100.02 136.89 39.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.399 -162.252 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.7 t -177.67 127.18 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.307 -166.361 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 60.12 29.79 19.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.699 -171.758 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.51 17.19 47.17 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 167.57 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.24 119.33 12.75 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 164.903 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 17.4 m-20 -62.03 -178.21 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.396 -159.291 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 51.2 m95 -146.47 -174.41 4.45 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 113.838 -1.528 . . . . 0.0 109.473 179.42 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.3 m80 -100.57 154.61 18.43 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.59 172.021 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.547 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.84 -56.75 29.26 Favored Pre-proline 0 C--O 1.241 0.634 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.851 -173.851 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.8 Cg_exo -64.01 -27.87 66.09 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 122.695 2.263 . . . . 0.0 113.545 -179.178 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -69.95 -53.49 17.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.218 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.911 HD21 ' CD2' ' A' ' 42' ' ' HIS . 2.2 tp -60.04 100.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.434 -159.082 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.446 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 4.5 mttt -132.64 147.28 52.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.217 -170.037 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -59.79 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.337 168.554 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.9 tt0 -146.47 25.41 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.753 157.722 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.11 -38.34 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.522 -169.045 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -104.88 -31.59 9.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.32 165.19 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 56.15 1.9 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 160.439 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.61 175.36 3.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.369 161.416 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.622 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -60.39 179.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.44 -162.095 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.756 HD13 ' HB3' ' A' ' 42' ' ' HIS . 6.8 mt -131.73 -172.18 2.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.3 -173.973 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 92.1 m -123.95 137.82 54.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 -176.025 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 t 59.69 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.558 165.372 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.58 44.1 0.18 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 160.224 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.08 11.08 56.35 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.878 -0.661 . . . . 0.0 111.553 -175.705 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.911 ' CD2' HD21 ' A' ' 28' ' ' LEU . 8.1 p80 -90.56 -169.49 2.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.897 -0.651 . . . . 0.0 110.39 172.041 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -154.27 154.45 33.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.14 166.837 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.505 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -100.3 146.92 26.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.155 -178.742 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -87.7 -45.88 9.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.813 166.1 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.82 79.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.009 166.264 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.78 -23.29 33.45 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 175.077 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 97.79 25.38 Favored Pre-proline 0 C--O 1.244 0.776 0 CA-C-N 115.003 -0.599 . . . . 0.0 109.697 -173.976 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.446 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 16.0 Cg_endo -65.77 142.05 68.26 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.629 2.219 . . . . 0.0 113.711 -170.161 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 1.9 m-85 -135.41 167.29 21.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.399 163.486 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 42.9 m -59.53 153.7 19.04 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 113.725 -1.58 . . . . 0.0 110.448 172.741 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -61.81 -45.91 91.79 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.321 179.001 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.5 m-70 -158.36 163.58 23.96 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.517 169.025 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -71.49 -3.8 10.76 Favored 'Cis proline' 0 N--CA 1.483 0.891 0 C-N-CA 122.748 -1.772 . . . . 0.0 113.817 -9.168 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 88.3 m -60.06 -59.16 5.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.407 -160.982 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -60.63 -40.74 93.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.454 -169.301 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.52 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 13.3 p -64.81 -21.29 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.422 176.835 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.228 -169.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.042 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -146.72 134.94 21.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.318 -169.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.4 t -84.38 114.94 57.96 Favored Pre-proline 0 C--O 1.25 1.123 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.158 -163.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -59.82 -20.54 59.73 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.787 2.325 . . . . 0.0 113.278 170.191 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -73.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.389 -175.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -93.55 -21.46 19.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.558 -165.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 72.61 57.22 0.13 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.47 -171.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.23 -168.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.99 159.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.46 152.24 22.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.572 162.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.9 t -112.09 112.35 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.627 -163.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 17.4 t80 -69.05 153.34 43.94 Favored 'General case' 0 N--CA 1.458 -0.038 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.285 176.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.495 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 2.7 m-85 -60.44 -62.05 2.15 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.835 -159.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.41 10.61 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.644 -173.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -102.55 13.95 33.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.449 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.0 154.72 17.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.228 -161.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -145.25 151.98 14.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.748 156.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.58 136.48 52.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.616 -169.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.9 t -174.83 131.83 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.185 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.593 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.1 mm? 60.04 34.52 21.39 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.558 -170.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.08 18.18 57.0 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 169.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -137.75 154.01 49.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 164.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.434 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.5 m-20 -88.14 176.9 7.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.367 -166.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -148.96 -177.25 5.7 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.251 -1.341 . . . . 0.0 109.074 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.7 m80 -99.54 143.22 30.03 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.475 169.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.71 -45.15 96.94 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.844 -167.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.3 Cg_endo -64.05 -36.46 48.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.589 2.192 . . . . 0.0 113.669 174.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.48 -46.71 84.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.233 -165.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 42' ' ' HIS . 4.3 tp -62.77 83.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.367 -166.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -142.21 149.72 40.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.425 -166.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -65.5 127.59 32.46 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.472 175.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 1.2 tt0 -95.97 22.53 7.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.255 -1.338 . . . . 0.0 110.177 171.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 -58.98 2.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.318 169.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.2 p -104.81 -19.94 13.75 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.851 -170.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.89 37.19 34.14 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 176.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -96.1 128.12 42.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.496 -0.352 . . . . 0.0 110.335 167.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.2 m -61.14 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 42' ' ' HIS . 57.1 mt -98.08 167.22 11.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.378 -164.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 39' ' ' SER . 59.4 m -125.28 173.78 8.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.228 -164.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.574 ' N ' HG22 ' A' ' 38' ' ' THR . 1.0 OUTLIER -61.13 91.96 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.48 -178.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.53 57.1 8.54 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.22 12.78 3.55 Favored Glycine 0 CA--C 1.524 0.597 0 CA-C-N 114.757 -0.721 . . . . 0.0 111.701 166.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.658 ' HB2' HD13 ' A' ' 37' ' ' LEU . 6.9 p80 -110.86 -168.96 1.37 Allowed 'General case' 0 C--O 1.231 0.084 0 CA-C-N 114.762 -0.719 . . . . 0.0 110.594 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.95 158.52 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.69 165.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -110.09 124.93 52.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.974 -160.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' HB3' ' HG3' ' A' ' 48' ' ' LYS . 86.3 t60 -99.53 163.07 12.66 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.121 158.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.46 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 16.4 mp0 -60.31 92.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.241 -160.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.89 45.99 15.09 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.586 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HG3' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -177.97 104.81 0.21 Allowed Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 121.6 0.714 . . . . 0.0 109.956 169.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -61.77 172.57 3.63 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.603 2.202 . . . . 0.0 113.668 167.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 63.5 m-85 -169.11 177.55 4.8 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.01 -171.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 83.9 m -58.21 140.69 52.57 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.136 -1.393 . . . . 0.0 110.066 160.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.73 -38.94 86.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.191 164.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 12.3 m-70 -153.21 173.45 4.59 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.342 165.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.8 Cg_endo -62.59 -18.71 4.6 Favored 'Cis proline' 0 N--CA 1.494 1.504 0 C-N-CA 121.248 -2.397 . . . . 0.0 112.537 -23.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.1 m -57.49 -41.69 81.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.146 -154.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -60.93 -48.02 83.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.412 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 24.8 t -72.03 -18.07 61.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.437 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.67 -47.2 7.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.288 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 49.9 mmm -93.53 -37.2 12.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.463 -169.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.494 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 74.7 m-85 -119.41 81.34 1.7 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.353 177.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 168.38 143.39 3.8 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -173.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -58.13 145.69 91.31 Favored 'Trans proline' 0 N--CA 1.484 0.965 0 C-N-CA 122.464 2.11 . . . . 0.0 113.573 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -133.9 -175.43 3.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.389 -169.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.63 -129.93 3.91 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -66.81 -77.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.333 -0.434 . . . . 0.0 110.421 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 164.37 44.82 0.02 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -170.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -104.09 32.8 3.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.372 -170.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.52 154.66 38.08 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.434 -1.067 . . . . 0.0 110.434 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 178.87 7.64 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -170.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -97.18 -35.22 10.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.268 -169.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -165.51 -49.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.117 -168.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.3 m -100.86 123.74 45.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.385 169.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 -70.05 167.62 17.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.379 -169.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t -164.26 -166.5 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.47 170.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -67.8 84.87 0.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.316 -169.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt . . . . . 0 C--O 1.24 0.596 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.349 -170.062 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.427 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 14.4 Cg_exo . . . . . 0 N--CA 1.485 1.012 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.85 140.82 21.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.386 -167.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.7 t -86.96 116.47 66.17 Favored Pre-proline 0 C--O 1.25 1.108 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.104 -163.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.7 Cg_endo -59.51 -18.08 44.76 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 C-N-CA 122.784 2.322 . . . . 0.0 113.233 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -84.06 -69.44 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.466 -171.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.95 -21.92 18.3 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.638 -168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 t70 72.29 53.33 0.18 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.457 -171.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -111.7 -168.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.981 159.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.49 152.33 23.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.724 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.3 t -112.2 111.23 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.633 -163.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -73.65 157.63 36.24 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.287 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.17 -62.32 1.95 Allowed 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -158.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.62 -12.34 61.5 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.723 -173.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 1.6 mp0 -102.31 44.75 0.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.058 170.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -111.2 150.17 29.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.412 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.45 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.3 m -140.74 146.34 24.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.528 155.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -115.46 138.35 51.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.748 -166.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -178.19 132.09 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.22 -171.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.05 20.67 9.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.572 -171.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.85 -24.41 21.16 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 170.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -105.17 154.55 20.05 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 114.87 -0.665 . . . . 0.0 110.137 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -92.2 176.89 6.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.375 -165.258 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 24.1 m95 -150.49 -175.14 4.98 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.233 -1.348 . . . . 0.0 108.971 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.4 m80 -100.13 150.27 22.67 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 113.963 -1.471 . . . . 0.0 110.624 168.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 22.6 mtp180 -61.32 -56.56 32.76 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.922 -170.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 5.9 Cg_endo -58.77 -36.92 96.33 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.413 2.075 . . . . 0.0 113.567 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.81 -46.36 90.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.285 -164.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.653 HD12 ' HG3' ' A' ' 49' ' ' PRO . 7.8 tp -60.02 89.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.236 -160.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.1 tttp -138.4 146.57 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.307 -162.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -66.2 123.64 20.48 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.446 171.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB2' ' HE3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -96.72 36.95 1.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.954 168.615 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.84 -44.38 0.88 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.208 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.8 p -116.7 -21.62 8.99 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.006 176.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.94 44.51 11.94 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -105.39 131.06 53.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.422 170.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.2 m -61.0 147.35 43.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.368 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.588 HD13 ' CB ' ' A' ' 42' ' ' HIS . 60.7 mt -110.93 173.99 6.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.331 -168.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.592 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -122.01 -175.61 3.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.381 -167.054 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG22 ' A' ' 38' ' ' THR . 16.7 t -66.71 -18.94 65.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.376 -167.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.9 62.91 0.08 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 171.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -129.15 12.33 6.08 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.588 ' CB ' HD13 ' A' ' 37' ' ' LEU . 5.8 p80 -103.87 -168.91 1.56 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.981 -0.609 . . . . 0.0 110.436 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.1 158.61 7.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.966 161.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.512 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 4.4 tt0 -115.19 121.31 42.57 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.015 -160.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.451 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 1.3 m80 -75.0 151.17 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.572 157.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.72 76.37 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.931 -176.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.39 -59.52 0.3 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -163.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.53 ' HE3' ' HB2' ' A' ' 31' ' ' GLU . 14.0 mtpp -155.32 140.19 12.05 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-O 121.339 0.59 . . . . 0.0 110.052 -160.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.653 ' HG3' HD12 ' A' ' 28' ' ' LEU . 12.2 Cg_endo -66.04 154.15 75.21 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.958 2.439 . . . . 0.0 113.568 165.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 28.7 m-85 -149.02 -167.24 2.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.84 166.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.6 m -57.7 134.24 56.04 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.287 166.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -68.22 -32.09 72.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.909 159.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.533 ' CG ' ' HB2' ' A' ' 57' ' ' SER . 11.9 m-70 -150.96 163.42 23.77 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.338 165.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -68.44 -22.53 8.56 Favored 'Cis proline' 0 N--CA 1.487 1.129 0 C-N-CA 122.427 -1.905 . . . . 0.0 112.798 -18.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 85.6 m -56.99 -43.02 81.32 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.214 -153.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -69.5 -37.8 77.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.471 170.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.538 ' HA ' ' HA2' ' A' ' 61' ' ' GLY . 48.1 t -60.77 -17.61 50.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.48 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -99.79 -38.96 8.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.187 -167.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.501 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 14.0 mmt -96.42 -21.49 17.73 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.431 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 59' ' ' MET . 49.7 m-85 -154.19 30.14 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.372 -167.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' A' ' 57' ' ' SER . . . -68.36 -52.52 26.2 Favored Glycine 0 CA--C 1.543 1.823 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -174.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 61' ' ' GLY . 2.9 Cg_exo -51.86 106.76 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.519 2.146 . . . . 0.0 113.434 -168.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' HG3' ' H ' ' A' ' 64' ' ' GLY . 2.8 tptp -98.8 157.56 16.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.467 169.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.413 ' H ' ' HG3' ' A' ' 63' ' ' LYS . . . 79.21 -135.43 15.41 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 -170.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -165.39 109.69 0.86 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.382 -170.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -127.57 47.12 1.04 Allowed Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 169.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -61.17 -43.26 99.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.35 -0.425 . . . . 0.0 110.387 170.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 176.41 -116.71 0.57 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -169.12 84.89 0.09 OUTLIER Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.34 162.26 17.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.425 . . . . 0.0 110.262 -170.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -106.75 -174.24 2.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.011 169.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 t -106.17 -164.24 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.342 -169.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -104.32 127.66 52.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.397 -168.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.401 ' O ' HG23 ' A' ' 74' ' ' THR . 14.2 t 58.33 91.16 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.234 174.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -80.64 -172.45 3.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.346 169.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 76' ' ' LYS . 1.4 mmmm . . . . . 0 C--O 1.241 0.607 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.325 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.466 0.525 . . . . 0.0 113.466 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -122.23 157.61 31.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.469 -175.006 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -84.92 119.92 73.14 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.246 -161.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -61.55 -25.02 78.93 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.778 2.319 . . . . 0.0 113.236 169.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -75.43 -74.36 0.21 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.421 -176.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -91.67 -22.41 20.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.608 -166.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 72.72 51.92 0.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.575 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.52 -169.01 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.841 158.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.3 155.0 19.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.449 160.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 47.9 t -112.29 112.13 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.666 -165.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.19 164.34 26.18 Favored 'General case' 0 C--N 1.334 -0.081 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.273 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.35 -62.4 1.9 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 -159.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -12.94 61.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.712 -173.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -101.22 44.55 1.01 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.093 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.54 144.57 40.55 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.483 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.12 119.65 5.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.606 154.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 95.9 m -99.97 141.49 32.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.365 -163.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.659 ' OG ' HD13 ' A' ' 19' ' ' LEU . 28.5 t -170.13 133.87 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.275 -163.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 ' OG ' ' A' ' 18' ' ' SER . 6.8 mp 59.87 18.34 7.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.471 161.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.66 -24.2 8.1 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 164.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -140.05 158.17 44.48 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.218 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.6 m-20 -84.31 178.33 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.301 -165.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 48.9 m95 -147.91 -174.69 4.63 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 113.689 -1.596 . . . . 0.0 109.486 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.6 m80 -99.92 157.81 16.26 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.198 -1.364 . . . . 0.0 110.659 170.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.573 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 ttp180 -66.83 -60.03 6.93 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.817 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -60.39 -20.43 63.23 Favored 'Trans proline' 0 N--CA 1.484 0.922 0 C-N-CA 122.394 2.063 . . . . 0.0 113.723 -179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.56 -54.64 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.19 -169.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 37' ' ' LEU . 1.3 tp -65.05 84.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.327 -163.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.58 148.62 52.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 -170.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.6 t -64.76 127.79 33.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.392 172.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -95.8 34.22 1.55 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.049 171.454 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -56.2 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.426 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.5 p -104.67 -17.93 14.48 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.085 -174.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.05 39.88 44.42 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 174.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -118.79 138.07 52.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.991 -0.605 . . . . 0.0 110.449 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -68.39 159.99 30.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.382 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.5 mt -124.91 123.47 39.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.468 -170.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -84.62 -168.05 2.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.528 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.9 t -76.01 73.06 2.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.395 -168.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.61 55.36 0.95 Allowed Glycine 0 CA--C 1.529 0.923 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 167.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.78 12.77 5.61 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 162.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 9.6 p80 -114.14 -168.6 1.38 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.24 -177.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -164.96 157.84 16.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.874 160.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.634 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -112.7 131.19 55.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.035 -161.102 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 86.4 t60 -96.44 163.56 13.0 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.371 160.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.458 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 11.5 tp10 -60.79 92.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.108 -162.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 55.25 7.55 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.614 -170.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 176.28 102.98 0.1 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 121.447 0.642 . . . . 0.0 109.876 165.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 18.0 Cg_endo -65.28 149.82 88.03 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.714 2.276 . . . . 0.0 113.627 169.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 50.6 m-85 -143.44 -178.84 6.07 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.007 169.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.5 m -56.23 138.95 49.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 113.49 -1.686 . . . . 0.0 110.802 165.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.7 -31.72 70.99 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.036 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.44 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 27.3 m-70 -161.37 162.38 21.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 CA-C-N 114.715 -1.129 . . . . 0.0 109.251 165.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -73.36 -13.27 19.53 Favored 'Cis proline' 0 N--CA 1.483 0.856 0 C-N-CA 122.65 -1.812 . . . . 0.0 113.609 -13.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 80.7 m -59.5 -42.01 91.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.72 -156.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -66.44 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.306 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -60.64 -11.64 7.88 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.42 -169.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.86 -58.88 2.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.352 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -43.06 9.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.401 -169.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 10.7 m-85 -113.1 110.23 20.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.354 -179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 170.55 -58.01 0.19 Allowed Glycine 0 CA--C 1.544 1.85 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 172.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -52.95 -82.33 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.997 0 C-N-CA 122.481 2.121 . . . . 0.0 113.603 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.6 -77.35 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.356 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 108.4 0.01 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -61.17 -49.52 76.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.361 -0.419 . . . . 0.0 110.305 -170.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.08 105.02 0.1 OUTLIER Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -170.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.526 ' HB3' ' NH1' ' A' ' 67' ' ' ARG . 4.7 mtm105 -63.02 -30.39 71.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.316 -0.442 . . . . 0.0 110.346 -170.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.11 103.71 0.33 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -170.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 112.67 -149.26 18.43 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.485 -1.046 . . . . 0.0 110.485 170.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.72 103.24 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.252 -169.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -141.63 113.91 8.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.053 168.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.93 -62.7 1.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.382 -169.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 m80 -61.06 169.03 2.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.401 -170.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.5 p -117.54 87.33 2.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.433 170.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 68.2 -79.09 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.364 169.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.502 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.432 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.46 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 12.2 Cg_endo . . . . . 0 N--CA 1.485 1.025 0 N-CA-C 113.612 0.581 . . . . 0.0 113.612 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -142.28 151.16 41.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.5 172.07 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.9 t -88.01 117.74 68.8 Favored Pre-proline 0 C--O 1.251 1.155 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.253 -162.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -59.72 -22.1 66.09 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.732 2.288 . . . . 0.0 113.171 169.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -74.09 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.441 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.61 -21.26 19.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.61 -164.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.43 58.58 0.13 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.452 -170.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.15 -168.56 1.54 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.01 160.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.8 mt-10 -105.76 152.57 23.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.63 161.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -112.44 113.09 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.595 -162.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -72.84 156.27 39.06 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.371 177.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -60.35 -62.3 1.97 Allowed 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.839 -159.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -1.4 10.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.736 -173.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -102.57 14.46 31.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.422 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.96 152.86 18.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.306 -161.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.634 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.5 153.56 13.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.65 156.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.33 142.69 35.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.767 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.457 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 38.7 t -177.46 133.35 0.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.284 172.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.523 ' HB3' ' HZ2' ' A' ' 21' ' ' LYS . 3.3 mm? 59.96 32.21 21.03 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.537 -172.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.86 18.34 68.43 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 167.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HZ2' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -140.4 155.11 46.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 165.339 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.46 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.6 m-20 -86.6 176.99 7.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.305 -164.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -149.27 -175.49 5.0 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.196 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.3 m80 -100.6 140.61 34.62 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.527 169.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.685 HH12 HG21 ' A' ' 36' ' ' THR . 17.3 tpt85 -62.02 -46.52 91.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 115.206 -0.907 . . . . 0.0 109.871 -173.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.573 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.0 Cg_exo -50.01 -39.62 50.17 Favored 'Trans proline' 0 N--CA 1.484 0.967 0 C-N-CA 122.724 2.283 . . . . 0.0 113.418 169.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.81 -47.62 37.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.268 -164.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.802 HD21 ' CD2' ' A' ' 42' ' ' HIS . 4.1 tp -66.16 77.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.488 -170.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 29' ' ' LYS . 15.5 ptmt -138.31 141.42 39.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.393 -171.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.5 t -60.26 122.01 13.43 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 172.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 20.0 mt-10 -96.88 38.59 1.22 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.166 167.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -39.1 0.76 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.382 -177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.8 p -120.6 -27.57 5.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.056 172.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.29 47.15 5.58 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.534 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -104.25 130.58 52.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.416 167.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.685 HG21 HH12 ' A' ' 25' ' ' ARG . 85.9 m -64.39 146.83 53.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.373 167.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 19.0 mt -114.89 131.03 56.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.401 -167.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -78.98 -167.86 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.482 168.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -65.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.453 -168.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -127.49 56.9 0.72 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.72 10.3 3.7 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 114.997 -0.602 . . . . 0.0 111.89 166.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.802 ' CD2' HD21 ' A' ' 28' ' ' LEU . 27.2 p80 -108.75 -170.16 1.62 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 111.026 -175.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.418 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -146.57 -163.21 1.7 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.845 168.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -171.12 132.83 0.84 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.302 174.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.476 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 64.3 t60 -95.24 159.3 15.08 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 154.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.68 90.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.018 -161.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.87 -44.09 1.21 Allowed Glycine 0 CA--C 1.53 1.004 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.733 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 7.2 mtmm -132.28 108.53 13.63 Favored Pre-proline 0 C--O 1.243 0.74 0 CA-C-O 121.139 0.495 . . . . 0.0 109.81 -159.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 16.1 Cg_endo -67.75 155.87 68.22 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 123.115 2.543 . . . . 0.0 113.648 165.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 65.3 m-85 -152.62 -162.16 1.44 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.858 169.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.3 m -57.45 139.09 54.16 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.316 162.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -60.61 -34.67 74.56 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.103 164.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.542 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.1 m-70 -158.56 173.1 5.31 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.386 164.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.527 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 24.1 Cg_endo -63.23 -18.95 5.13 Favored 'Cis proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.466 -2.306 . . . . 0.0 112.603 -22.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.4 m -57.33 -40.36 77.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.219 -154.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -60.93 -48.31 82.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.309 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.542 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 17.1 t -65.52 -18.31 65.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.644 177.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.46 -53.69 5.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.126 -165.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.09 -30.75 7.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.394 -171.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 11.3 m-85 -103.88 -173.8 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.226 166.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 139.2 140.46 3.95 Favored Glycine 0 CA--C 1.544 1.847 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 173.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -58.04 131.17 41.93 Favored 'Trans proline' 0 N--CA 1.486 1.053 0 C-N-CA 122.479 2.119 . . . . 0.0 113.558 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.496 ' HD3' ' H ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -61.18 -17.51 53.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.384 -171.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -162.34 -84.24 0.05 OUTLIER Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 169.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.34 -42.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.293 169.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -117.85 -71.86 0.42 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 169.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.482 ' CZ ' ' HB2' ' A' ' 67' ' ' ARG . 2.7 ptm85 -178.7 156.0 0.85 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.408 -0.396 . . . . 0.0 110.444 169.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.64 -69.6 1.29 Allowed Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 157.28 -175.07 34.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -170.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.96 -40.78 12.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.429 -0.386 . . . . 0.0 110.267 -169.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 107.18 18.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.966 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.98 98.63 1.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.456 169.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -93.04 -170.96 2.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.291 169.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.2 m -63.71 -34.69 78.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.369 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -170.16 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.389 169.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.365 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HD2' ' HE3' ' A' ' 21' ' ' LYS . 3.1 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.545 0.556 . . . . 0.0 113.545 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HG2' ' N ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -119.39 142.87 47.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.339 -169.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.9 t -78.72 118.68 73.81 Favored Pre-proline 0 C--O 1.252 1.207 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.47 -162.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -61.8 -12.0 23.43 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 C-N-CA 123.011 2.474 . . . . 0.0 113.479 170.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.576 ' HD2' ' HD2' ' A' ' 49' ' ' PRO . 3.7 ttpp -93.52 -77.08 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.58 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.8 p -88.5 -19.47 26.39 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.985 -163.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.72 56.16 0.18 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.497 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.05 -172.57 2.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.013 161.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -97.55 152.78 18.67 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.68 166.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -116.34 111.71 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.549 -163.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.7 158.56 31.99 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.367 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.36 -65.86 0.62 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.803 -159.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -12.51 61.62 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.701 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.97 46.72 0.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.95 168.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.7 ptt85 -118.56 149.91 40.55 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.77 170.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 28' ' ' LEU . 19.3 m -138.62 149.25 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.554 157.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -114.06 136.99 52.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.475 -163.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 24.3 t -178.23 135.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.393 -170.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.98 17.91 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.717 -176.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.36 -24.89 30.38 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 166.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' HD2' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -114.98 164.9 13.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.843 -0.679 . . . . 0.0 110.07 179.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 3.8 m-20 -90.8 177.44 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.283 -165.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.0 m95 -153.03 173.72 15.07 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 113.907 -1.497 . . . . 0.0 108.99 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.7 m80 -92.08 142.65 27.28 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.466 174.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.18 -49.87 86.49 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.793 -172.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.6 Cg_endo -58.29 -41.02 70.66 Favored 'Trans proline' 0 N--CA 1.484 0.915 0 C-N-CA 122.551 2.168 . . . . 0.0 113.613 172.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.535 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.5 m -61.1 -48.13 83.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.213 -171.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.819 HD11 ' CE1' ' A' ' 42' ' ' HIS . 4.2 tp -67.71 94.3 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.379 -167.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.449 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.7 ttmt -153.16 149.46 28.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.471 -171.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -73.24 122.72 22.39 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.372 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -97.78 42.03 1.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 110.042 167.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 13.3 tptp -132.3 -49.87 0.93 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.328 172.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -109.26 -31.35 7.6 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.763 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.17 49.16 5.39 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -104.04 132.47 50.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.405 -0.397 . . . . 0.0 110.346 161.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.414 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 9.2 m -60.56 136.97 58.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.345 166.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 39.8 mt -97.89 169.66 9.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.315 -163.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.5 -174.97 2.66 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.355 -161.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -72.83 67.89 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.316 165.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.94 53.62 2.81 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 172.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.39 12.24 8.45 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 160.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.819 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.5 p80 -110.62 -169.61 1.49 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 114.911 -0.644 . . . . 0.0 110.469 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.425 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.55 -163.28 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.72 165.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.4 pp20? -155.32 139.29 16.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.189 169.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.496 ' CD2' ' HG2' ' A' ' 46' ' ' GLU . 41.2 t60 -124.59 104.32 8.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.058 172.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.496 ' HG2' ' CD2' ' A' ' 45' ' ' HIS . 6.5 mm-40 58.59 43.35 19.23 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.799 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 99.84 -20.16 50.37 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 168.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.71 99.73 14.36 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.412 0.625 . . . . 0.0 109.867 -167.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.576 ' HD2' ' HD2' ' A' ' 5' ' ' LYS . 9.7 Cg_endo -66.1 153.9 76.25 Favored 'Trans proline' 0 N--CA 1.484 0.948 0 C-N-CA 122.429 2.086 . . . . 0.0 113.602 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 38.3 m-85 -151.46 -165.75 2.33 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.04 167.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.6 m -57.61 132.26 52.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.99 -1.459 . . . . 0.0 110.395 165.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.86 -36.27 78.74 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.917 162.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 22.5 m-70 -152.8 168.49 11.32 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.134 161.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 20.1 Cg_endo -67.57 -22.79 7.88 Favored 'Cis proline' 0 N--CA 1.489 1.232 0 C-N-CA 122.43 -1.904 . . . . 0.0 112.838 -17.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.4 m -56.96 -41.2 77.9 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.286 -153.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.39 -61.39 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.368 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -92.38 23.96 3.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.516 -166.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -121.44 -45.76 2.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.354 172.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.415 ' HA ' ' CE ' ' A' ' 59' ' ' MET . 24.1 mmt -106.2 -31.33 8.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.42 -169.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.44 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -85.2 93.04 8.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.356 -167.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.34 -65.39 0.01 OUTLIER Glycine 0 CA--C 1.543 1.798 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 171.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.543 ' HB3' ' CE1' ' A' ' 73' ' ' HIS . 1.6 Cg_endo -56.77 -154.84 0.01 OUTLIER 'Trans proline' 0 N--CA 1.488 1.149 0 C-N-CA 122.471 2.114 . . . . 0.0 113.421 168.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -179.15 131.93 0.11 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.387 168.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 132.86 125.68 2.65 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 83.59 1.23 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.391 . . . . 0.0 110.325 169.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -178.86 -104.16 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -170.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -159.65 157.28 29.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.425 -170.303 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 131.52 5.72 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 65.17 100.68 0.01 OUTLIER Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.9 32.99 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.431 -0.385 . . . . 0.0 110.264 -169.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -96.26 166.58 11.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.087 168.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.75 -82.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.373 -169.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.543 ' CE1' ' HB3' ' A' ' 62' ' ' PRO . 1.9 m-70 -99.72 135.66 40.8 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.405 -170.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 17.0 p 60.69 -172.96 0.13 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.825 176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -133.72 -80.48 0.47 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.341 -170.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 tptm . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.343 -170.033 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.575 ' H2 ' ' HE2' ' A' ' 2' ' ' LYS . 1.1 Cg_endo . . . . . 0 N--CA 1.487 1.12 0 N-CA-C 113.5 0.539 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.575 ' HE2' ' H2 ' ' A' ' 1' ' ' PRO . 3.4 mmtt -130.72 139.48 50.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.378 172.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 28.7 t -82.92 122.84 78.19 Favored Pre-proline 0 C--O 1.25 1.097 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.178 -162.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -62.63 -30.97 79.54 Favored 'Trans proline' 0 N--CA 1.488 1.205 0 C-N-CA 122.99 2.46 . . . . 0.0 113.23 169.015 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -71.08 0.23 Allowed 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.394 -176.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.9 -22.75 16.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.601 -164.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 72.4 68.37 0.13 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.456 -168.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 -168.23 1.91 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.208 162.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.69 151.41 23.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.341 164.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 62.9 t -120.41 111.25 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.846 -162.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.0 163.6 25.74 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.431 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.57 -59.44 5.4 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.887 -160.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.641 -176.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.644 ' O ' HG13 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -108.03 37.87 2.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.058 166.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.801 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -118.69 131.84 56.15 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.943 163.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.539 HG21 HD22 ' A' ' 28' ' ' LEU . 19.9 m -112.04 167.62 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.508 156.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 m -126.58 138.03 53.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.546 -167.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 35.6 t -177.42 137.5 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.395 -177.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.516 ' CD2' ' HG2' ' A' ' 44' ' ' GLU . 3.3 mm? 60.01 17.94 7.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.689 -177.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.13 -24.95 29.48 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.569 -1.013 . . . . 0.0 110.569 166.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.0 160.84 19.11 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 114.883 -0.658 . . . . 0.0 110.129 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 4.4 m-20 -88.42 177.03 6.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.271 -165.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.2 m95 -150.15 163.14 38.98 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.067 -1.424 . . . . 0.0 109.362 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -82.88 138.45 33.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.347 170.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -60.91 -46.69 96.81 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.779 -169.083 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_exo -54.59 -43.8 55.59 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 122.697 2.265 . . . . 0.0 113.537 169.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.83 -49.81 74.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.306 -169.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.539 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -68.16 88.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.376 -168.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.443 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.3 142.47 27.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.333 -169.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -60.12 122.13 13.65 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.466 171.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.578 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 27.1 mt-10 -96.32 38.23 1.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.964 165.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.79 -50.84 1.24 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.046 175.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.9 p -112.08 -20.42 11.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.874 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.8 44.4 20.03 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -100.58 127.18 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.335 169.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 72.0 m -61.44 139.8 58.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.412 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 42' ' ' HIS . 77.9 mt -104.32 116.55 32.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.292 -169.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -118.57 -171.23 2.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.531 -172.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 t 57.83 -90.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.098 163.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.36 43.15 0.07 OUTLIER Glycine 0 CA--C 1.533 1.18 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 161.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.7 24.24 15.62 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -167.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 37' ' ' LEU . 7.7 p80 -101.16 -169.41 1.69 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.597 -0.802 . . . . 0.0 110.52 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.38 158.32 7.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.816 162.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp20? -115.05 133.65 55.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.025 -159.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.49 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 69.2 t60 -102.7 162.64 12.76 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 157.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.437 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 3.9 mm-40 -60.67 90.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.169 -161.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 116.77 -19.08 12.56 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.757 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -141.1 105.37 6.13 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-O 121.254 0.55 . . . . 0.0 109.773 -162.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 14.6 Cg_endo -66.43 161.08 42.54 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.872 2.381 . . . . 0.0 113.62 165.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -159.14 -171.18 3.26 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.0 173.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.5 m -58.08 139.54 54.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 113.666 -1.606 . . . . 0.0 110.321 165.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -60.36 -35.44 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.261 164.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 11.5 m-70 -156.35 171.3 7.54 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.378 167.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 25.2 Cg_endo -62.65 -18.11 4.64 Favored 'Cis proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.135 -2.444 . . . . 0.0 112.539 -24.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.2 m -57.61 -41.74 81.86 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.129 -154.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -61.06 -60.02 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.294 174.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.448 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -70.97 -11.4 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.433 -168.577 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.59 -53.16 6.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.372 177.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.96 -37.61 9.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.417 -168.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 11.8 m-85 -121.71 78.03 1.41 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.392 -172.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.28 69.08 0.01 OUTLIER Glycine 0 CA--C 1.544 1.862 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -174.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -57.12 -16.69 22.3 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.524 2.15 . . . . 0.0 113.425 168.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -105.59 -174.68 2.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.363 -169.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.66 143.21 14.81 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 65' ' ' PHE . 0.3 OUTLIER -113.41 19.45 16.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.997 0.427 . . . . 0.0 110.394 -169.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -85.53 115.46 4.16 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -171.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -131.13 105.02 7.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.281 -0.46 . . . . 0.0 110.296 170.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -147.19 -75.77 0.02 OUTLIER Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 66.5 79.63 0.2 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.49 81.09 1.49 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.515 . . . . 0.0 110.331 -176.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -170.93 46.39 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.012 -168.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.93 -32.18 71.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.389 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.98 -170.16 1.61 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.336 -169.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.0 m 69.75 135.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.498 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -119.55 -171.85 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.291 -169.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.361 170.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.484 0.97 0 N-CA-C 113.571 0.566 . . . . 0.0 113.571 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -123.88 146.98 48.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.466 -169.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.2 t -83.41 117.0 67.36 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.275 -165.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.608 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.63 -22.08 73.57 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.786 2.324 . . . . 0.0 113.238 169.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.44 -73.57 0.27 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.451 -175.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -92.11 -22.54 19.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.526 -167.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t0 72.99 60.48 0.1 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.555 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.45 -169.23 1.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.068 159.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.76 153.1 18.49 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.477 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.7 t -112.71 112.98 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.573 -167.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -69.0 152.69 44.93 Favored 'General case' 0 C--N 1.335 -0.065 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.212 175.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -59.97 4.55 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.712 -158.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.86 -0.29 10.92 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.581 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.42 15.49 28.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.336 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -96.89 153.41 17.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.248 -161.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.61 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -146.2 149.16 16.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.692 157.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.72 136.82 48.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.753 -169.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.444 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.45 138.77 0.23 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.31 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.46 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 59.98 23.95 13.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.663 -176.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.16 -24.78 28.6 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 166.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -115.43 163.5 15.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.793 -0.704 . . . . 0.0 110.247 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.466 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.73 176.02 7.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.418 -168.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.608 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 32.2 m95 -147.28 -177.54 5.74 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.115 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -102.42 141.06 35.85 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.521 169.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.563 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 11.5 mtm180 -60.88 -50.84 83.21 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.896 -171.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 7.0 Cg_exo -50.54 -36.83 50.86 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.386 2.057 . . . . 0.0 113.521 171.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.34 -52.28 23.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.372 -168.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 42' ' ' HIS . 3.9 tp -64.4 92.23 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.374 -167.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.452 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 pttp -150.15 147.97 28.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.455 -170.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -64.65 121.42 14.44 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.29 171.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.474 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -95.36 44.91 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.033 163.562 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.477 ' NZ ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -137.18 -45.26 0.56 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.352 175.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.6 p -115.62 -33.53 5.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.924 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.45 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 81.67 50.15 5.11 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.72 129.1 55.92 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.248 158.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.8 m -61.3 136.95 58.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.286 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 14.9 mt -92.09 134.61 34.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.351 -161.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.71 HG22 ' OG ' ' A' ' 39' ' ' SER . 80.2 m -97.37 146.36 25.25 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.937 175.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.71 ' OG ' HG22 ' A' ' 38' ' ' THR . 28.3 m 61.24 -156.14 0.35 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.952 159.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -89.99 54.92 3.67 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 156.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -105.45 14.08 47.12 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.789 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.8 p80 -113.1 -167.39 1.18 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-N 113.927 -1.137 . . . . 0.0 110.469 173.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.89 159.87 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.301 160.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.449 ' CG ' ' HG ' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -126.1 122.65 36.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.069 -165.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -92.65 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.935 161.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.46 42.25 21.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.832 170.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 23.59 61.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -119.54 84.78 30.72 Favored Pre-proline 0 CA--C 1.541 0.621 0 CA-C-O 121.547 0.689 . . . . 0.0 109.825 176.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.409 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 11.1 Cg_endo -63.61 148.74 92.15 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.511 2.141 . . . . 0.0 113.761 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 52.2 m-85 -154.49 -167.37 2.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.971 171.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.1 m -57.12 133.44 55.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 113.496 -1.684 . . . . 0.0 110.499 163.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -25.5 66.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.003 162.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 20.0 m-70 -166.63 162.69 11.41 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.356 169.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -71.28 -13.83 15.24 Favored 'Cis proline' 0 N--CA 1.482 0.831 0 C-N-CA 122.5 -1.875 . . . . 0.0 113.509 -15.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.0 m -59.7 -43.41 94.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.65 -156.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -60.9 -54.43 45.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.494 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -77.72 -16.01 58.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.358 -167.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.77 -46.58 10.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.258 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.477 ' HG3' ' NZ ' ' A' ' 32' ' ' LYS . 3.9 mmm -106.69 -34.94 7.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.39 -169.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.34 101.45 10.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.301 -167.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.94 77.3 0.03 OUTLIER Glycine 0 CA--C 1.543 1.805 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 171.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -55.94 -11.43 5.47 Favored 'Trans proline' 0 N--CA 1.487 1.137 0 C-N-CA 122.454 2.103 . . . . 0.0 113.323 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 64.05 98.65 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.448 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.89 116.19 0.4 Allowed Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -170.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -63.62 -170.12 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.381 -0.409 . . . . 0.0 110.357 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.95 129.49 46.51 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -169.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 170.38 1.61 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.393 -169.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.97 -64.21 0.26 Allowed Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.454 -1.059 . . . . 0.0 110.454 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 60.95 82.91 0.07 OUTLIER Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 170.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -149.16 -162.1 1.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.158 0.504 . . . . 0.0 110.307 -169.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 58.79 -84.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.692 -167.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.7 m 65.8 -74.96 0.05 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.443 -168.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -61.15 130.7 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.443 -170.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.88 88.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.404 170.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 75' ' ' PHE . 1.5 p90 -130.62 117.91 20.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.356 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.241 0.638 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.375 -170.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.442 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 20.9 Cg_exo . . . . . 0 N--CA 1.486 1.034 0 N-CA-C 113.615 0.583 . . . . 0.0 113.615 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.95 160.03 27.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.416 -167.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -85.92 121.11 73.07 Favored Pre-proline 0 C--O 1.251 1.148 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.096 -164.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.579 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -61.25 -28.9 85.52 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 C-N-CA 122.724 2.283 . . . . 0.0 113.163 169.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -70.07 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.426 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.45 -22.13 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.619 -166.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 72.59 54.45 0.15 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.475 -171.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -168.71 1.36 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 159.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 152.88 23.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.583 161.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.7 t -112.7 112.32 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.54 -162.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -75.54 159.76 30.91 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.361 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -60.45 -62.42 1.87 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.778 -159.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.58 11.11 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.688 -173.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -101.99 13.75 33.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.505 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -97.04 151.07 20.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.36 -160.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.37 156.2 15.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.736 156.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.93 137.13 52.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.667 -169.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.436 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 42.4 t -174.14 136.82 0.52 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.271 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 59.99 18.75 7.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.618 -172.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.58 28.37 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.39 155.24 19.31 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 114.89 -0.655 . . . . 0.0 110.184 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.442 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.2 m-20 -88.5 177.19 6.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.323 -166.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 26.6 m95 -149.17 -175.74 5.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.153 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -98.67 145.55 26.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.463 168.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.553 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.74 -44.86 96.46 Favored Pre-proline 0 CA--C 1.545 0.774 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.838 -166.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.5 Cg_endo -64.71 -35.58 45.65 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.532 2.155 . . . . 0.0 113.547 173.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.22 -44.35 84.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.339 -163.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.546 HD12 ' HG3' ' A' ' 49' ' ' PRO . 3.8 tp -60.73 82.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.354 -174.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.57 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 10.7 ttmt -148.58 144.88 27.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.14 -0.937 . . . . 0.0 110.331 -162.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -65.02 126.17 27.2 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.536 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -96.88 27.37 4.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.065 166.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.44 -35.78 2.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.279 -175.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -126.09 -25.98 3.47 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.062 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.58 49.47 6.62 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -175.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.03 124.2 45.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.317 164.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.57 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 95.4 m -61.18 135.09 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.164 167.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.693 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.4 mt -100.58 139.47 36.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.392 -164.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 73.5 m -60.62 154.35 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.184 163.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.6 t -66.29 62.69 0.04 OUTLIER 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.486 160.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 146.95 144.74 4.08 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.371 -162.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.91 13.53 83.55 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 119.853 -1.165 . . . . 0.0 111.483 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.693 ' HB2' HD13 ' A' ' 37' ' ' LEU . 8.7 p80 -112.22 -170.0 1.58 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 114.667 -0.767 . . . . 0.0 110.813 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -152.04 -162.77 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.604 165.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.592 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.5 tt0 -170.02 138.1 1.68 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.183 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.51 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 9.8 p80 -96.49 173.03 7.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.775 157.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 89.01 0.21 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.083 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.07 -65.95 0.33 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -168.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -152.61 144.78 16.79 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-O 121.521 0.677 . . . . 0.0 109.96 -162.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.592 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.4 Cg_endo -72.73 171.26 17.65 Favored 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.834 2.356 . . . . 0.0 113.62 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 29.5 m-85 -155.94 -164.55 1.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.241 165.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.4 m -57.91 135.68 56.93 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.258 162.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -60.85 -34.52 74.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.054 162.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 25.3 m-70 -157.6 164.25 22.11 Favored Pre-proline 0 CA--C 1.552 1.03 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.335 166.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.47 -15.69 16.93 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.584 -1.84 . . . . 0.0 113.534 -14.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.0 m -59.57 -41.91 91.28 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.826 -156.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.477 ' CE2' ' CE2' ' A' ' 60' ' ' PHE . 9.6 t80 -61.18 -56.94 14.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.452 172.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.53 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.7 t -62.99 -20.51 65.35 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.372 -171.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.02 -47.22 5.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.184 -166.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.9 mmm -98.68 -20.03 17.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.382 -163.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 0.6 OUTLIER -61.05 99.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.351 -163.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.51 -137.37 2.69 Favored Glycine 0 CA--C 1.545 1.924 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 167.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -57.97 -59.72 0.5 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 C-N-CA 122.483 2.122 . . . . 0.0 113.378 166.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.83 -49.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.263 167.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.7 -172.27 6.52 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 167.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -141.41 -52.22 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.27 -170.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -104.97 176.07 22.57 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -85.41 144.9 27.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.391 -0.404 . . . . 0.0 110.364 -169.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -119.49 -67.3 0.3 Allowed Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 170.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 61.79 97.39 0.01 OUTLIER Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 170.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -175.53 143.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.439 -0.381 . . . . 0.0 110.279 169.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 58.4 102.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.67 167.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.2 t -177.02 98.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.398 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.8 p80 58.36 95.98 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.682 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -63.83 -160.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.428 170.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -61.03 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.387 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 76' ' ' LYS . 6.4 tptp . . . . . 0 C--O 1.24 0.579 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.401 -170.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.402 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 10.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.64 0.592 . . . . 0.0 113.64 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 147.36 41.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.405 -170.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.6 t -85.64 118.94 71.57 Favored Pre-proline 0 C--O 1.25 1.13 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.178 -164.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.574 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.0 Cg_endo -59.49 -27.51 85.14 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 122.518 2.145 . . . . 0.0 113.131 169.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -72.63 -70.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.448 -174.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -96.78 -21.92 17.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.626 -165.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 72.33 53.18 0.17 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.544 -173.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -112.72 -169.06 1.41 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.944 159.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -101.98 151.01 22.63 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.596 163.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.927 HG22 ' CD2' ' A' ' 24' ' ' HIS . 46.8 t -110.55 110.69 33.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.616 -167.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.43 161.67 29.03 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.385 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -60.15 -62.3 1.97 Allowed 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -158.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.14 60.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.731 -175.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -104.39 49.26 0.82 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.861 167.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 143.13 45.85 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.504 -1.225 . . . . 0.0 110.601 170.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 m -132.5 117.93 33.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.442 152.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.1 m -97.75 142.43 29.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.402 -173.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.1 t -177.72 137.27 0.2 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.089 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.843 HD23 ' OE2' ' A' ' 44' ' ' GLU . 4.6 mp 60.27 16.88 6.52 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.431 -1.258 . . . . 0.0 110.603 -172.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.99 -25.63 24.74 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 164.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -117.17 149.67 39.98 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.807 -0.696 . . . . 0.0 110.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.3 OUTLIER -85.7 177.69 7.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.193 -165.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.574 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.2 m95 -151.49 -176.59 5.65 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.483 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.927 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.2 m80 -97.71 150.21 21.45 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.59 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.7 ttt180 -61.3 -48.87 90.14 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.83 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 3.9 Cg_exo -66.85 -26.27 44.75 Favored 'Trans proline' 0 N--CA 1.484 0.931 0 C-N-CA 122.502 2.134 . . . . 0.0 113.569 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.55 -51.97 10.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.228 -164.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.567 HD12 ' CD2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -61.92 91.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.403 -160.844 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.517 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.8 mtpp -145.76 153.39 40.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.327 -172.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -65.23 122.42 17.07 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.242 163.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -96.0 28.53 3.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.117 169.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -50.42 2.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.074 177.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.9 p -112.26 -20.25 11.93 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.916 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.46 40.12 20.01 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 126.36 41.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.435 -0.383 . . . . 0.0 110.326 167.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.4 m -61.08 137.21 58.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.27 168.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 46.1 mt -99.64 161.24 13.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -164.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -98.73 -163.53 1.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.229 -166.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.567 ' H ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -93.49 20.86 6.78 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.471 -177.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.22 55.34 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.34 12.77 4.34 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 170.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 12.6 p80 -106.73 -168.94 1.48 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.707 -0.747 . . . . 0.0 110.745 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -150.61 -169.97 3.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.991 165.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.843 ' OE2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -132.21 141.24 48.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.124 170.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.6 t60 -139.92 101.54 4.2 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.846 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 58.62 46.42 14.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.627 -169.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 63.54 19.36 62.4 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.611 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.92 98.5 42.17 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 121.199 0.523 . . . . 0.0 109.73 169.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 11.3 Cg_endo -54.94 141.37 78.42 Favored 'Trans proline' 0 N--CA 1.487 1.088 0 C-N-CA 122.055 1.837 . . . . 0.0 113.446 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 97.5 m-85 -150.49 -179.23 7.05 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.106 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.8 m -56.72 131.16 48.34 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.472 165.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.97 -33.64 73.52 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.886 161.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.6 m-70 -155.94 164.83 20.01 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.258 163.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.8 Cg_endo -73.06 -16.82 17.48 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.696 -1.793 . . . . 0.0 113.616 -13.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.7 m -59.59 -43.92 93.52 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.778 -156.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -61.11 -55.34 33.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.316 177.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 29.6 t -80.94 -16.79 52.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.469 -165.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.82 -40.52 17.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.309 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 31.7 mmm -78.23 -48.35 15.96 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.413 -178.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 80.9 m-85 -98.19 87.39 3.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.427 -168.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 177.97 76.78 0.06 OUTLIER Glycine 0 CA--C 1.544 1.859 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -172.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -62.27 -85.57 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.644 2.23 . . . . 0.0 113.504 -169.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.03 120.06 24.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.26 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.78 -173.26 6.0 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.69 -65.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.413 -0.394 . . . . 0.0 110.434 169.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 94.16 -95.48 1.93 Allowed Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 -175.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -87.32 116.35 25.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.381 -170.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 148.97 58.27 0.01 OUTLIER Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -170.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -152.69 -130.82 1.59 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.49 133.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.137 -0.531 . . . . 0.0 110.414 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -133.43 -74.3 0.49 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.026 -169.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.0 p -113.53 -164.93 0.96 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.406 -169.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 71.63 25.91 3.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.345 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.53 69.34 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.414 169.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 66.62 176.38 0.23 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.407 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.62 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.437 169.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.419 ' H2 ' ' H ' ' A' ' 2' ' ' LYS . 3.6 Cg_endo . . . . . 0 N--CA 1.484 0.931 0 N-CA-C 113.568 0.564 . . . . 0.0 113.568 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.419 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -138.17 139.95 39.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.443 170.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.1 t -86.07 115.64 62.68 Favored Pre-proline 0 C--O 1.25 1.114 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.258 -164.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.573 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -60.05 -16.79 41.34 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 C-N-CA 122.771 2.314 . . . . 0.0 113.313 170.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -69.21 0.67 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.52 -171.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -94.21 -21.44 19.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.608 -170.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.34 52.1 0.18 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.496 -171.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.06 -168.49 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.856 160.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -106.51 152.08 24.15 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.606 161.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -111.65 111.85 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.653 -164.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.483 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 6.2 t80 -75.46 157.84 33.47 Favored 'General case' 0 N--CA 1.458 -0.054 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.311 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -59.78 -62.1 2.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 -157.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.55 -11.32 60.86 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.671 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.483 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.2 pt-20 -102.73 42.97 1.1 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.17 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.89 149.87 29.25 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.454 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.3 m -141.44 148.63 20.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.627 155.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.55 137.61 50.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.657 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.431 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 15.8 t -176.33 128.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.336 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 59.93 35.37 21.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.605 -170.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.82 18.04 52.13 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HG2' ' N ' ' A' ' 22' ' ' ASP . 20.7 ttmt -137.11 153.61 50.48 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 164.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 m-20 -88.68 177.08 6.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.392 -165.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.573 ' CE3' ' HD2' ' A' ' 4' ' ' PRO . 23.4 m95 -151.15 -173.25 4.44 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.954 -177.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -102.94 146.03 28.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 113.894 -1.503 . . . . 0.0 110.54 169.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.6 OUTLIER -60.91 -50.13 86.23 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.862 -169.204 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.569 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 6.5 Cg_exo -62.42 -34.8 75.44 Favored 'Trans proline' 0 N--CA 1.484 0.933 0 C-N-CA 122.549 2.166 . . . . 0.0 113.49 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.77 -52.9 58.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.232 -167.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.733 HD23 ' O ' ' A' ' 37' ' ' LEU . 2.1 tp -60.42 93.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.253 -164.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.543 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.1 mttp -148.15 139.1 23.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.356 -164.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.2 t -65.66 120.81 13.63 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.354 166.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 5.7 pt-20 -98.69 39.74 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.755 167.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' A' ' 59' ' ' MET . 0.1 OUTLIER -132.18 -39.32 1.06 Allowed 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.288 179.238 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.7 p -119.89 -22.2 6.87 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.12 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.99 41.44 12.32 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -95.19 122.55 37.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.49 -0.355 . . . . 0.0 110.372 167.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 90.8 m -61.09 135.62 57.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.317 170.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.733 ' O ' HD23 ' A' ' 28' ' ' LEU . 87.1 mt -101.7 97.83 8.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.314 -167.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.4 t -60.05 -160.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.352 161.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -68.94 0.2 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.611 170.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.91 -161.99 9.8 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 154.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.53 69.16 0.36 Allowed Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 165.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.683 ' NE2' HD21 ' A' ' 28' ' ' LEU . 24.0 p80 -90.77 -170.83 2.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.912 -0.644 . . . . 0.0 110.951 169.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.422 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -165.28 -168.9 1.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.196 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.9 pp20? -152.88 139.7 19.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.057 -169.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -137.25 106.61 6.08 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.856 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.38 33.19 22.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.906 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.46 -27.57 10.48 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 166.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 103.01 20.55 Favored Pre-proline 0 C--O 1.244 0.771 0 CA-C-O 121.328 0.585 . . . . 0.0 109.845 -170.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.57 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.7 Cg_endo -63.75 147.81 92.33 Favored 'Trans proline' 0 N--CA 1.484 0.923 0 C-N-CA 122.485 2.123 . . . . 0.0 113.669 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 4.3 m-85 -139.89 -165.27 1.86 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.78 164.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.9 m -57.56 135.11 56.63 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.099 159.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.433 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 13.6 t-20 -62.81 -33.0 74.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.927 161.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.443 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 21.6 m-70 -157.29 162.41 27.5 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.408 169.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -71.54 -14.9 15.59 Favored 'Cis proline' 0 N--CA 1.482 0.826 0 C-N-CA 122.548 -1.855 . . . . 0.0 113.477 -14.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.3 m -59.84 -45.95 90.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.691 -156.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -60.84 -53.61 55.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.454 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.443 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.5 p -66.96 -28.71 68.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.334 -170.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.43 -46.93 15.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.302 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . 1.6 tpt -86.95 -40.28 14.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.545 -169.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -81.19 91.91 6.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.381 -169.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.76 87.07 1.98 Allowed Glycine 0 CA--C 1.544 1.855 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -56.55 107.88 0.3 Allowed 'Trans proline' 0 N--CA 1.488 1.173 0 C-N-CA 122.426 2.084 . . . . 0.0 113.293 167.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -70.48 81.42 0.57 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.448 -164.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 61.69 -165.03 19.93 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 169.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -169.55 80.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.491 -0.355 . . . . 0.0 110.123 166.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.31 155.48 39.74 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -166.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.89 -39.3 10.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.333 168.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 148.58 97.0 0.18 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 170.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -138.84 102.32 0.35 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.461 -1.055 . . . . 0.0 110.461 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -173.24 82.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.341 -0.43 . . . . 0.0 110.294 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -157.43 84.15 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.074 -168.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.8 t -88.52 158.04 18.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.353 -169.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -101.69 132.87 47.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.323 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.5 m -126.63 92.93 3.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.412 -170.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -116.07 19.38 15.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.48 169.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? . . . . . 0 C--O 1.24 0.582 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.439 -171.294 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.604 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 2.4 Cg_endo . . . . . 0 N--CA 1.487 1.106 0 N-CA-C 113.457 0.522 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.23 139.0 52.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.471 170.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.4 t -85.77 116.63 66.42 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.144 -165.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.616 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -60.33 -23.55 74.86 Favored 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 122.723 2.282 . . . . 0.0 113.283 169.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -70.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.466 -174.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.0 p -94.91 -22.08 18.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.658 -167.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.48 57.58 0.14 Allowed 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.521 -171.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -117.19 -168.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.919 160.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -104.42 153.61 20.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.688 162.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.913 HG22 ' CD2' ' A' ' 24' ' ' HIS . 40.8 t -113.04 114.21 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.537 -163.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -71.99 156.38 39.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.396 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -60.51 -62.26 1.99 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.837 -159.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.37 -1.17 9.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.688 -173.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.82 14.81 31.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.432 178.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.31 152.05 19.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.286 -161.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.491 HG22 ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -144.73 150.12 16.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.646 155.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 m -113.58 135.14 54.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.803 -168.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.7 t -177.69 139.62 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.422 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.09 30.24 19.73 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.629 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.42 18.49 79.38 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 166.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -152.79 164.7 37.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.448 -0.376 . . . . 0.0 110.163 166.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 3.8 m-20 -90.65 176.79 6.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.392 -166.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.616 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.9 m95 -147.45 -176.71 5.35 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.166 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.913 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.3 m80 -101.36 142.62 32.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.499 168.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.72 -45.37 96.95 Favored Pre-proline 0 CA--C 1.543 0.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.819 -168.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 6.6 Cg_endo -62.96 -34.03 72.56 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.513 2.142 . . . . 0.0 113.647 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -67.48 -56.02 11.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.279 -166.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.769 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.1 tp -60.59 89.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.391 -164.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.526 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.54 146.32 29.4 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.418 -174.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.3 t -60.12 124.71 21.09 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.354 170.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 50' ' ' TYR . 1.3 tm-20 -96.34 20.1 10.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.133 169.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -105.32 -60.24 1.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.317 166.366 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.6 p -105.81 -21.54 13.15 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.825 -168.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 78.5 39.85 20.72 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.38 121.41 37.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.903 0.382 . . . . 0.0 110.194 166.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.99 132.51 54.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.288 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.596 HD13 ' HB2' ' A' ' 42' ' ' HIS . 60.7 mt -96.8 123.2 40.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.314 -168.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.532 HG23 ' N ' ' A' ' 40' ' ' GLY . 4.7 t -60.11 -162.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.544 168.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -95.65 32.49 1.81 Allowed 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.522 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.532 ' N ' HG23 ' A' ' 38' ' ' THR . . . -168.0 143.83 8.45 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -170.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.85 13.84 83.2 Favored Glycine 0 N--CA 1.468 0.787 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.284 163.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.769 ' CE1' HD11 ' A' ' 28' ' ' LEU . 10.1 p80 -106.1 -168.72 1.47 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.581 -0.81 . . . . 0.0 110.713 169.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.453 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -157.67 -177.4 6.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.244 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -168.8 124.6 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.881 -166.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.463 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 84.2 t60 -155.39 121.46 5.14 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.694 -179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 58.47 39.51 25.0 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.796 -176.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 -21.39 37.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm -98.18 102.81 15.05 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 121.826 0.822 . . . . 0.0 109.845 -168.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.549 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 13.5 Cg_endo -59.34 147.87 89.08 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.022 1.814 . . . . 0.0 113.372 168.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 9.8 m-85 -154.92 -166.75 2.39 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.241 169.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.2 m -57.63 135.37 56.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.372 163.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -60.62 -30.92 70.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.144 162.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.526 ' CE1' ' HB3' ' A' ' 57' ' ' SER . 30.5 m-70 -162.63 164.9 16.06 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.369 167.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.447 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -71.68 -14.34 15.9 Favored 'Cis proline' 0 N--CA 1.482 0.82 0 C-N-CA 122.517 -1.868 . . . . 0.0 113.586 -14.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.1 m -59.85 -42.3 93.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -156.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.09 -39.58 90.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.376 176.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.526 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 24.7 p -76.12 -18.09 59.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -99.18 -43.42 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.206 -168.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.428 ' CG ' ' HD3' ' A' ' 32' ' ' LYS . 25.3 mtp -60.76 -45.2 95.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.47 171.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.463 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 1.4 m-85 -68.88 85.81 0.33 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.342 -177.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.489 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 159.9 58.33 0.01 OUTLIER Glycine 0 CA--C 1.543 1.822 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 -170.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.489 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 8.1 Cg_exo -58.32 -76.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.485 1.028 0 C-N-CA 122.607 2.205 . . . . 0.0 113.498 -170.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? 63.75 85.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.285 -167.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.64 100.09 0.25 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -168.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 61.12 -169.98 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.329 -0.435 . . . . 0.0 110.325 169.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 159.66 -167.76 35.3 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 169.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.7 mmm-85 -128.95 117.68 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.257 -0.472 . . . . 0.0 110.396 170.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 172.53 -24.88 0.08 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 170.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 144.82 -81.23 0.22 Allowed Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 170.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.37 -175.85 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.324 -0.438 . . . . 0.0 110.336 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 58.97 -85.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.776 -167.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.4 p -171.58 -54.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.433 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.489 ' O ' HG22 ' A' ' 74' ' ' THR . 1.9 m-70 65.14 165.51 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.375 169.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 73' ' ' HIS . 4.5 t 60.44 28.61 18.27 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.873 175.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -120.16 149.64 41.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.4 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.549 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.397 170.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.45 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 1.5 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -134.67 156.7 48.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.424 170.835 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.8 t -81.39 119.26 75.21 Favored Pre-proline 0 C--O 1.25 1.111 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.346 -161.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.603 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.2 Cg_endo -61.19 -19.03 61.85 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 C-N-CA 122.878 2.385 . . . . 0.0 113.233 167.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.67 -77.26 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.47 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -91.5 -19.56 22.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.903 -164.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.23 55.03 0.17 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.495 -173.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -114.74 -168.64 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.995 160.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 7.7 mt-10 -104.77 153.24 21.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.546 161.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.911 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -113.21 113.27 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.492 -163.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.38 157.15 37.48 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.42 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.39 -62.38 1.9 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 -159.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.54 -1.07 9.85 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.553 -173.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -102.81 14.21 32.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.442 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.52 152.52 18.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.266 -161.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.648 HG21 HD22 ' A' ' 28' ' ' LEU . 16.3 m -145.04 147.67 18.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.578 155.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.51 137.06 52.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.675 -168.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 10.5 t -178.08 130.01 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.297 -171.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.14 28.51 18.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.538 -171.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.01 18.05 70.38 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -138.68 155.1 48.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 164.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.45 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -88.9 177.03 6.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.375 -165.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.603 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.3 m95 -150.56 -176.74 5.61 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.102 -177.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.911 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -100.57 142.38 32.11 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.448 169.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.447 ' N ' ' CD ' ' A' ' 26' ' ' PRO . 5.8 mtm180 -61.08 -46.31 96.24 Favored Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.781 -170.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 7.9 Cg_exo -60.84 -36.1 85.45 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.608 2.205 . . . . 0.0 113.535 174.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.44 -46.89 74.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.343 -168.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.802 HD11 ' CE1' ' A' ' 42' ' ' HIS . 7.6 tp -62.88 93.07 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.441 -166.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.49 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -149.31 142.48 25.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -60.01 124.42 20.15 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.551 174.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.35 23.88 5.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.215 171.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.457 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -113.16 -59.52 2.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.378 168.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.4 p -104.0 -16.15 15.4 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.863 -169.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 66.87 48.97 58.02 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -171.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -104.57 115.23 29.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.453 -0.373 . . . . 0.0 110.323 167.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.9 m -61.26 134.94 57.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.881 HD13 ' HB2' ' A' ' 42' ' ' HIS . 75.8 mt -97.46 125.81 42.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.425 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -71.6 -162.45 0.08 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.481 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -61.21 -15.29 32.78 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.605 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.642 ' H ' HG23 ' A' ' 38' ' ' THR . . . -159.25 -179.62 34.21 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -169.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.82 15.42 81.33 Favored Glycine 0 C--N 1.342 0.872 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.337 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.881 ' HB2' HD13 ' A' ' 37' ' ' LEU . 7.0 p80 -109.71 -168.47 1.33 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 114.521 -0.84 . . . . 0.0 110.579 173.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -159.12 -169.11 2.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.332 170.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.487 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -150.77 131.69 14.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.989 -168.388 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.49 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 39.9 t60 -135.62 100.45 4.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.994 176.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 58.6 43.89 18.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.832 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.443 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.09 -21.53 44.68 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 170.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -97.89 100.94 9.48 Favored Pre-proline 0 C--O 1.242 0.686 0 CA-C-O 121.283 0.563 . . . . 0.0 109.807 -172.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 10.4 Cg_endo -62.31 164.99 16.03 Favored 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.378 2.052 . . . . 0.0 113.737 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 71.9 m-85 -161.99 176.61 10.59 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.073 -171.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.8 m -57.86 128.41 36.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.961 -1.472 . . . . 0.0 110.054 160.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -60.86 -32.93 72.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.912 162.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 7.2 m-70 -154.26 161.4 29.38 Favored Pre-proline 0 CA--C 1.551 1.018 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.154 163.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -74.39 -18.25 18.21 Favored 'Cis proline' 0 C--N 1.354 0.835 0 C-N-CA 122.718 -1.784 . . . . 0.0 113.61 -12.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -58.92 -45.34 90.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.89 -154.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -61.05 -61.89 2.25 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.0 p -72.68 -11.91 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.444 -173.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.89 -56.49 3.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.068 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HG3' ' HE2' ' A' ' 32' ' ' LYS . 3.6 tmm? -84.92 -39.42 18.2 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 113.584 -1.644 . . . . 0.0 109.939 -170.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.49 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 56.5 m-85 -87.55 -167.32 1.85 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.781 159.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.596 ' H ' ' HD2' ' A' ' 62' ' ' PRO . . . -108.27 -60.9 0.55 Allowed Glycine 0 CA--C 1.544 1.895 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 -158.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.596 ' HD2' ' H ' ' A' ' 61' ' ' GLY . 20.7 Cg_exo -47.44 -87.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.815 2.343 . . . . 0.0 113.733 -161.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 177.86 176.48 0.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.443 -171.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.28 61.39 1.08 Allowed Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.248 -1.141 . . . . 0.0 110.248 167.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -133.25 -73.76 0.49 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.337 -168.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.56 72.09 1.16 Allowed Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 170.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.474 ' NH2' ' HG ' ' A' ' 19' ' ' LEU . 11.2 mtm180 64.99 -167.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.414 175.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 160.29 -34.64 0.43 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -110.39 -30.65 3.27 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -173.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.48 176.54 8.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.323 -0.438 . . . . 0.0 110.244 -169.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 58.55 76.74 0.33 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.572 168.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.474 ' HB2' ' HE2' ' A' ' 76' ' ' LYS . 12.7 t -138.89 -62.16 0.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.413 -169.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -139.97 -79.07 0.3 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.416 -169.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.466 ' HB ' ' CE2' ' A' ' 75' ' ' PHE . 1.6 p -146.31 -54.16 0.26 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.357 178.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.466 ' CE2' ' HB ' ' A' ' 74' ' ' THR . 10.4 m-85 -141.45 113.25 7.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.324 -169.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 72' ' ' SER . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.544 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.405 170.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.487 1.092 0 N-CA-C 113.542 0.555 . . . . 0.0 113.542 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 6.4 pttp -126.12 156.21 40.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.36 -168.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -85.28 116.97 67.76 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.126 -163.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.611 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_endo -60.16 -21.85 67.74 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.584 2.189 . . . . 0.0 113.108 169.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -72.47 0.38 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.484 -173.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.6 p -91.84 -21.16 20.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.598 -169.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.02 52.29 0.13 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.597 -171.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -108.61 -169.33 1.48 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.884 158.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.497 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -106.76 151.72 24.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.531 160.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.7 t -112.68 124.91 69.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.711 -166.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.537 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 13.1 p90 -101.29 160.31 14.52 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.488 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HA ' ' HB3' ' A' ' 15' ' ' ARG . 7.0 p90 -59.61 -40.96 89.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.89 -158.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.479 ' H ' ' HD1' ' A' ' 11' ' ' TYR . . . -81.06 -0.09 38.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 119.553 -0.859 . . . . 0.0 111.161 -163.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 11' ' ' TYR . 0.7 OUTLIER -113.37 9.74 18.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.686 166.203 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.433 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -80.66 141.15 35.22 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.36 -159.116 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.2 m -146.82 125.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.024 160.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -98.79 142.03 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.434 -168.556 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.5 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 22.6 t -177.6 138.65 0.22 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.566 -168.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' N ' HD22 ' A' ' 19' ' ' LEU . 3.2 mm? 59.92 32.49 21.21 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.726 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.41 -24.09 21.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 168.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.4 ' CE ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.35 -174.01 2.52 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 114.864 -0.668 . . . . 0.0 110.022 177.089 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.2 m-20 -106.4 177.05 4.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.309 -173.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.611 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 37.4 m95 -149.71 -172.29 4.11 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.267 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.5 m80 -101.65 159.44 15.31 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.558 170.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -74.3 -57.05 2.31 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.717 -175.522 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.448 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 4.2 Cg_exo -49.44 -22.47 6.16 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 C-N-CA 122.282 1.988 . . . . 0.0 113.411 172.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -87.0 -58.17 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.267 -167.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.92 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -62.81 83.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.348 -173.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.534 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 4.5 mtmt -156.67 139.55 15.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.266 -164.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -63.12 123.47 18.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.432 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 8.0 pt-20 -97.93 27.67 4.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.819 164.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.15 -50.76 2.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.351 170.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.99 -21.23 10.16 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.955 -175.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.45 43.02 16.69 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -99.81 122.42 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.343 168.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.0 m -60.84 137.19 58.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.32 168.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.821 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.6 mt -101.15 148.64 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.442 -162.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.504 HG22 ' N ' ' A' ' 39' ' ' SER . 97.5 m -102.73 168.81 9.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.369 -171.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.504 ' N ' HG22 ' A' ' 38' ' ' THR . 0.1 OUTLIER -62.87 78.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.57 179.517 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.43 58.49 0.96 Allowed Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.33 9.61 1.71 Allowed Glycine 0 C--N 1.334 0.458 0 CA-C-N 114.435 -0.882 . . . . 0.0 111.996 168.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.92 ' CE1' HD11 ' A' ' 28' ' ' LEU . 6.1 p80 -112.12 -171.31 1.82 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.983 0.42 . . . . 0.0 110.555 -170.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 56' ' ' TYR . . . -141.64 -164.72 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.612 166.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.478 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.75 146.74 2.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.218 162.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.521 ' NE2' ' HB2' ' A' ' 48' ' ' LYS . 34.2 p80 -86.96 -165.76 1.38 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.548 155.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.17 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.285 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.66 39.1 41.61 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 172.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.521 ' HB2' ' NE2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -158.34 108.39 1.69 Allowed Pre-proline 0 CA--C 1.544 0.738 0 CA-C-O 121.315 0.579 . . . . 0.0 109.804 166.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.478 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 11.8 Cg_endo -71.46 154.14 60.59 Favored 'Trans proline' 0 N--CA 1.483 0.878 0 C-N-CA 122.963 2.442 . . . . 0.0 113.71 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 8.4 m-85 -147.14 -164.73 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.908 164.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.8 m -57.49 138.13 55.47 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.261 161.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -60.66 -30.66 70.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.172 163.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.538 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 27.9 m-70 -164.37 164.84 13.57 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.355 168.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 12.2 Cg_endo -70.91 -12.96 14.6 Favored 'Cis proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.447 -1.897 . . . . 0.0 113.556 -15.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 68.9 m -59.72 -42.55 93.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.711 -157.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CD2' ' CB ' ' A' ' 43' ' ' ALA . 23.0 t80 -60.87 -45.07 95.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.507 176.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.538 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 25.3 t -76.2 -25.16 54.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.527 -172.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.55 -46.83 13.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.286 -174.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -81.83 -43.76 17.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.338 -169.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.492 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 4.2 m-85 -93.47 96.11 9.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.412 -168.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.88 -165.74 19.76 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -60.96 -76.1 0.02 OUTLIER 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.528 2.152 . . . . 0.0 113.533 -170.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.74 146.66 45.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.473 -166.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.65 80.75 0.06 OUTLIER Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -67.34 -37.07 82.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.365 170.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 134.67 -42.16 1.38 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -169.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.7 113.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.491 171.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.02 133.49 49.18 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -170.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.55 64.66 0.35 Allowed Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 170.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.45 -57.74 1.28 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.313 170.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -125.63 -51.86 1.59 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.2 t 65.99 -78.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.349 170.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.511 ' O ' HG22 ' A' ' 74' ' ' THR . 5.3 p80 -98.8 15.23 26.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.725 -170.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.751 HG23 ' CD1' ' A' ' 75' ' ' PHE . 3.7 t 59.34 -163.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.002 167.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.751 ' CD1' HG23 ' A' ' 74' ' ' THR . 1.6 m-85 66.91 -69.43 0.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.357 -171.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.6 mttp . . . . . 0 C--O 1.241 0.63 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.357 170.04 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.486 1.065 0 N-CA-C 113.453 0.52 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.97 144.19 33.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.408 169.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.5 t -83.18 117.63 69.19 Favored Pre-proline 0 C--O 1.248 1.025 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.17 -162.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.1 Cg_endo -60.46 -22.14 70.59 Favored 'Trans proline' 0 N--CA 1.489 1.227 0 C-N-CA 122.749 2.299 . . . . 0.0 113.222 169.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -73.25 0.31 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.396 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.3 p -94.44 -20.87 19.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.692 -165.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 t0 72.57 57.09 0.14 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.547 -172.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.95 -168.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.02 159.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.6 152.97 21.79 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.573 161.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.1 t -112.14 112.05 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.472 -163.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -75.75 159.51 30.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.382 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.34 -62.55 1.78 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.866 -159.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.48 -1.88 12.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.645 -173.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -101.86 14.08 32.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.478 178.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -98.74 146.31 26.02 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.374 -160.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.963 HG21 HD22 ' A' ' 28' ' ' LEU . 12.1 m -141.92 126.74 17.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.248 152.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 82.8 m -95.57 132.38 40.76 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.401 -175.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.475 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.3 OUTLIER -162.65 122.58 2.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.224 -159.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.684 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.05 23.77 12.98 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.67 -176.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.73 17.06 66.63 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.696 -0.961 . . . . 0.0 110.696 164.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -151.21 150.38 30.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 162.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.2 178.29 8.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.252 -160.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.9 m95 -152.2 -177.32 6.11 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.237 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.9 m80 -101.09 143.63 30.98 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.053 -1.431 . . . . 0.0 110.526 170.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.4 ttp180 -61.18 -46.48 95.82 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.78 -173.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -58.88 -27.64 84.97 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.647 2.231 . . . . 0.0 113.585 174.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -81.04 -46.96 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.963 HD22 HG21 ' A' ' 16' ' ' VAL . 8.0 tp -60.78 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.442 -173.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 13.1 mtmt -135.9 127.48 28.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.409 -164.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.0 t -61.35 125.88 25.37 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.353 167.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.0 tp10 -95.65 30.4 2.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.123 168.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.98 -43.03 1.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.173 -177.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.3 p -120.09 -9.32 9.62 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.815 -1.084 . . . . 0.0 111.212 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.82 37.9 95.36 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -95.0 121.47 36.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.28 172.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.2 m -61.31 135.97 57.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.17 166.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 42' ' ' HIS . 27.3 mt -102.11 123.45 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.378 -165.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.7 t -84.38 -175.65 5.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.498 169.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.4 p -61.06 -9.85 5.15 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.506 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.81 ' H ' HG23 ' A' ' 38' ' ' THR . . . -63.51 -170.04 1.5 Allowed Glycine 0 CA--C 1.532 1.094 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.736 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.19 76.52 2.13 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -158.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.889 ' CE1' HD21 ' A' ' 28' ' ' LEU . 20.3 p80 -98.61 -167.02 1.43 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.264 -0.968 . . . . 0.0 110.572 169.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.58 -166.67 1.54 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.799 -169.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.53 154.26 3.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.167 164.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.54 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 15.0 p80 -92.21 -167.66 1.81 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.533 156.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.98 91.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.173 -176.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.67 53.87 9.28 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 178.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 6.1 ttmm -179.78 106.96 0.19 Allowed Pre-proline 0 CA--C 1.541 0.613 0 CA-C-O 121.764 0.792 . . . . 0.0 110.021 165.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.8 Cg_endo -71.21 148.82 56.6 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.744 2.296 . . . . 0.0 113.665 173.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.7 m-85 -144.1 -171.91 3.66 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.767 162.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 79.5 m -58.2 137.7 56.83 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.156 165.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -67.88 -34.37 76.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.58 -1.191 . . . . 0.0 109.993 163.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.436 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.8 m-70 -150.36 167.68 12.52 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.406 165.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.29 -20.39 6.64 Favored 'Cis proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.818 -2.159 . . . . 0.0 112.628 -21.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.6 m -57.31 -48.13 79.73 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.235 -153.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.479 ' CD1' ' HB2' ' A' ' 60' ' ' PHE . 55.0 t80 -61.07 -55.46 32.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.409 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.436 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.9 t -60.82 -17.74 51.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.564 -174.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.35 -53.49 4.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.193 -168.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -95.69 -38.34 10.4 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.332 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.479 ' HB2' ' CD1' ' A' ' 56' ' ' TYR . 31.4 m-85 -91.0 -170.24 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.177 165.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.404 ' N ' ' CD ' ' A' ' 62' ' ' PRO . . . 169.41 -56.04 0.2 Allowed Glycine 0 CA--C 1.542 1.763 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.404 ' CD ' ' N ' ' A' ' 61' ' ' GLY . 7.1 Cg_exo -50.95 112.38 0.76 Allowed 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.429 2.086 . . . . 0.0 113.587 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HB3' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -158.81 122.61 3.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.436 -169.422 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.55 -33.89 87.87 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.477 ' CE2' ' HB3' ' A' ' 63' ' ' LYS . 6.2 m-85 69.81 -80.45 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.331 -0.434 . . . . 0.0 110.386 169.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -114.5 176.48 16.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -169.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.54 83.56 2.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.392 -170.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 155.01 134.04 1.82 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -170.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -160.24 163.71 34.02 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -178.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.32 -162.75 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.226 169.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.42 111.32 21.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.038 168.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.5 p -177.54 165.87 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.308 169.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 t60 71.74 -67.67 0.25 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.375 170.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.9 p -61.01 -86.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.406 -169.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -108.3 122.29 46.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.292 -169.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.281 170.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.086 0 N-CA-C 113.478 0.53 . . . . 0.0 113.478 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -145.13 136.89 25.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.277 -170.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 32.0 t -85.11 119.92 72.97 Favored Pre-proline 0 C--O 1.25 1.104 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.043 -162.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -63.25 -19.6 68.81 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 C-N-CA 122.971 2.447 . . . . 0.0 113.375 171.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.498 ' HD3' ' HB3' ' A' ' 27' ' ' CYS . 0.2 OUTLIER -85.05 -64.47 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.473 -171.053 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.5 p -96.48 -23.76 16.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.684 -170.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 72.21 64.55 0.13 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.512 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.5 OUTLIER -127.38 -170.81 2.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.105 162.019 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -99.66 150.48 22.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.306 163.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.928 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.9 t -112.58 113.64 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.505 -163.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -68.43 150.79 47.7 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.461 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.35 -62.82 1.59 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.834 -159.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.21 -1.88 11.55 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.603 -174.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -101.85 13.2 35.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.302 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -96.44 155.8 16.61 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.249 -161.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.95 HG21 HD22 ' A' ' 28' ' ' LEU . 15.5 m -144.49 145.16 21.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.423 155.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -114.69 137.59 51.73 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.652 -168.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.476 ' C ' HD22 ' A' ' 19' ' ' LEU . 8.7 t -177.69 128.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.334 -169.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.658 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.06 28.63 18.2 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.588 -172.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.38 17.5 72.51 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 167.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mmtt -137.22 153.19 50.45 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 163.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.41 176.77 7.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.399 -167.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.572 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 33.9 m95 -148.38 175.53 11.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 114.231 -1.35 . . . . 0.0 109.411 -177.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.928 ' CD2' HG22 ' A' ' 10' ' ' VAL . 40.5 m80 -96.81 138.97 33.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.392 167.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.555 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.7 tpp180 -60.94 -47.06 96.63 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.861 -165.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -62.23 -35.24 75.42 Favored 'Trans proline' 0 N--CA 1.484 0.914 0 C-N-CA 122.53 2.153 . . . . 0.0 113.666 174.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.498 ' HB3' ' HD3' ' A' ' 5' ' ' LYS . 1.3 m -61.21 -41.32 96.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.173 -171.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.981 HD11 ' CE1' ' A' ' 42' ' ' HIS . 10.2 tp -67.79 103.35 1.41 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -164.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -146.92 157.08 43.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.31 -178.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.1 t -72.18 127.42 32.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.367 171.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -95.83 35.87 1.35 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 114.078 -1.419 . . . . 0.0 110.168 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.502 ' HB2' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -138.08 -46.47 0.52 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.283 -176.258 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.0 p -115.87 -18.78 10.67 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.124 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.29 38.85 28.2 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -108.0 136.9 46.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.007 -0.597 . . . . 0.0 110.565 173.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -61.68 150.3 36.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.325 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.616 HD13 ' CB ' ' A' ' 42' ' ' HIS . 42.6 mt -113.28 154.9 26.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.398 -167.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.629 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -88.21 -170.57 3.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.396 -175.214 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.629 ' H ' HG22 ' A' ' 38' ' ' THR . 16.3 t -61.65 -42.37 98.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.416 -176.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.58 59.5 0.42 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -128.21 13.45 6.31 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 111.63 -0.588 . . . . 0.0 111.63 173.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.981 ' CE1' HD11 ' A' ' 28' ' ' LEU . 8.6 p80 -114.04 -167.65 1.24 Allowed 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.031 -0.584 . . . . 0.0 110.481 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -174.11 159.1 3.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.044 165.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.8 pp20? -110.3 134.96 51.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.074 -163.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 85.4 t60 -128.11 99.09 5.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.229 -1.35 . . . . 0.0 109.878 175.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 58.47 41.58 22.48 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.747 -173.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.435 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 96.18 -22.61 38.81 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 168.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -92.36 102.27 6.26 Favored Pre-proline 0 C--O 1.243 0.742 0 CA-C-O 121.253 0.549 . . . . 0.0 109.812 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 47' ' ' GLY . 8.1 Cg_endo -58.61 167.91 4.65 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.482 2.121 . . . . 0.0 113.468 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 32.1 m-85 -164.46 170.17 16.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.892 -167.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -57.3 133.98 55.58 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 113.85 -1.523 . . . . 0.0 110.269 160.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -27.99 68.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.07 164.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 32.2 m-70 -163.8 163.79 15.55 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.354 165.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -72.36 -13.53 17.32 Favored 'Cis proline' 0 N--CA 1.482 0.824 0 C-N-CA 122.645 -1.815 . . . . 0.0 113.578 -13.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.656 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 76.2 m -59.83 -46.34 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.715 -157.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.13 -47.91 80.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.339 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.26 -14.14 61.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.298 178.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . -69.98 -57.0 5.52 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.183 176.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 60' ' ' PHE . 16.2 mmt -91.53 -16.19 27.57 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 113.749 -1.568 . . . . 0.0 110.346 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CD2' ' A' ' 45' ' ' HIS . 3.2 m-85 -147.64 -168.61 3.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.845 -165.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.36 145.94 10.47 Favored Glycine 0 CA--C 1.543 1.811 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -176.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -61.97 -158.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.503 2.135 . . . . 0.0 113.617 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.99 147.71 23.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.418 169.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.25 107.81 1.81 Allowed Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.464 -1.055 . . . . 0.0 110.464 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 66.96 -80.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.398 . . . . 0.0 110.374 169.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.53 118.72 11.19 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 -169.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.08 140.29 49.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.421 170.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.59 -102.88 0.67 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 170.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.25 63.98 1.68 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 170.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -168.82 123.91 0.9 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.371 -0.414 . . . . 0.0 110.278 169.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -135.14 -75.98 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.958 -168.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.57 139.93 21.36 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.446 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.76 -50.79 5.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.298 169.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.4 HG22 ' H ' ' A' ' 75' ' ' PHE . 0.2 OUTLIER 69.32 171.01 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.37 -170.57 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.4 ' H ' HG22 ' A' ' 74' ' ' THR . 1.6 m-85 71.77 -75.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.438 -177.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.345 170.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.488 ' HD3' ' NZ ' ' A' ' 21' ' ' LYS . 10.2 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.54 0.554 . . . . 0.0 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.429 ' H ' ' H2 ' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -118.86 159.2 24.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.423 -168.828 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.8 t -81.94 118.72 73.12 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.391 -162.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -59.24 -19.38 49.78 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.766 2.311 . . . . 0.0 113.252 167.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.562 ' HE3' ' HD3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -83.36 -77.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.431 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.24 -18.8 22.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.035 -162.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 t70 71.88 51.92 0.22 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.485 -175.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -168.6 1.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.008 161.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' HG2' ' CD ' ' A' ' 2' ' ' LYS . 4.0 mt-10 -104.71 153.07 21.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.657 162.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.7 t -112.39 112.95 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.581 -163.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -70.66 154.98 41.33 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.29 177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -60.68 -62.29 1.97 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.796 -160.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -1.48 10.82 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.614 -173.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -102.46 14.52 31.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.475 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ptt-85 -96.42 155.13 16.89 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.214 -161.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.811 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -147.31 151.73 13.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.812 157.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.58 137.84 47.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.664 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.442 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.8 t -176.02 137.58 0.32 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.143 178.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.578 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 59.97 18.97 8.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.574 -171.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.3 -24.45 28.93 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.488 ' NZ ' ' HD3' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -107.0 157.64 17.64 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.943 -0.629 . . . . 0.0 110.269 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.26 176.83 7.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.382 -166.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.8 m95 -149.54 -176.08 5.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.105 -177.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.0 m80 -100.36 138.61 37.19 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.91 -1.495 . . . . 0.0 110.543 169.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 1.3 ttp-105 -61.17 -47.6 94.23 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.803 -175.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.2 Cg_exo -52.44 -33.5 57.3 Favored 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 122.584 2.189 . . . . 0.0 113.6 170.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -77.63 -55.53 5.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.252 -170.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.811 HD22 HG21 ' A' ' 16' ' ' VAL . 3.0 tp -61.48 78.26 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.381 -175.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 ptpt -137.31 155.44 49.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.416 170.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -59.51 125.88 25.38 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.651 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -93.53 22.67 5.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.226 170.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.485 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.08 -60.11 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.33 166.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 24.4 p -106.32 -21.22 13.16 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.902 -167.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.84 40.98 20.12 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 124.06 33.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.445 -0.377 . . . . 0.0 110.26 165.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 36.6 m -61.56 135.84 57.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.133 166.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 95.9 mt -102.97 110.16 21.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.388 -161.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 39' ' ' SER . 4.9 t -98.86 -167.06 1.43 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.44 171.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.657 ' HB3' HG23 ' A' ' 38' ' ' THR . 24.9 p 58.79 -162.73 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.564 158.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -122.36 47.74 1.0 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 157.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -103.14 15.31 54.92 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.43 ' HE1' ' OG ' ' A' ' 18' ' ' SER . 27.2 p80 -104.6 -170.48 1.77 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.473 0.654 . . . . 0.0 111.055 176.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.48 -166.05 2.37 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.161 175.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.533 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -170.87 164.91 7.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.885 164.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.536 ' NE2' ' HG2' ' A' ' 48' ' ' LYS . 31.8 p80 -111.05 106.14 15.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.715 163.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.15 14.85 2.95 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.006 165.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.539 ' HA2' ' HB2' ' A' ' 4' ' ' PRO . . . 126.99 16.28 2.43 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.562 ' HD3' ' HE3' ' A' ' 5' ' ' LYS . 9.4 tppt? -129.66 86.49 55.38 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -173.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.566 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.4 Cg_endo -71.29 155.56 60.33 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.665 2.243 . . . . 0.0 113.721 -168.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.7 m-85 -152.99 -164.12 1.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.813 167.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 90.1 m -58.18 137.34 57.1 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.103 159.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -61.32 -31.58 71.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.964 162.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.447 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.2 m-70 -161.53 164.56 18.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.34 170.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.415 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.9 Cg_endo -70.31 -11.7 13.06 Favored 'Cis proline' 0 N--CA 1.483 0.906 0 C-N-CA 122.465 -1.89 . . . . 0.0 113.365 -15.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.5 m -61.99 -45.38 93.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.685 -157.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -61.03 -47.49 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.425 176.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -72.05 -15.07 62.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.543 -176.009 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.88 -47.83 8.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.209 -173.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 15.9 mtp -90.2 -40.41 12.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.36 -169.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.45 ' CZ ' ' CB ' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -82.19 95.57 7.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.401 -166.49 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -125.07 67.88 0.52 Allowed Glycine 0 CA--C 1.544 1.906 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 168.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.03 114.01 1.43 Allowed 'Trans proline' 0 N--CA 1.486 1.075 0 C-N-CA 122.579 2.186 . . . . 0.0 113.448 -168.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.443 ' N ' ' HD2' ' A' ' 63' ' ' LYS . 0.1 OUTLIER 60.99 86.97 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.387 169.622 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.24 122.13 4.69 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 -169.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -166.4 -79.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.377 -0.412 . . . . 0.0 110.434 170.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -98.87 -91.1 2.0 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -170.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.7 mtp180 -107.03 -80.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.37 -170.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.66 131.46 6.0 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -170.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -67.68 -172.23 6.09 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 170.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.714 ' HB3' HG21 ' A' ' 74' ' ' THR . . . 61.71 -169.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.39 -0.405 . . . . 0.0 110.279 169.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.43 163.12 17.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.015 -168.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 72.3 m 65.9 -84.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.412 169.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -166.92 108.13 0.65 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.348 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.714 HG21 ' HB3' ' A' ' 70' ' ' ALA . 3.9 t -159.17 -59.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.379 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.594 ' H ' HG23 ' A' ' 74' ' ' THR . 4.9 t80 67.31 -79.59 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.408 170.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 1.5 tmmt? . . . . . 0 C--O 1.24 0.597 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.34 175.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 113.538 0.553 . . . . 0.0 113.538 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 3.1 pttt -119.76 154.88 33.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.355 -167.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.2 t -78.44 117.64 67.52 Favored Pre-proline 0 C--O 1.248 0.974 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.637 -164.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -62.7 -6.88 9.8 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 123.031 2.487 . . . . 0.0 113.397 168.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.556 ' CE ' ' HD2' ' A' ' 49' ' ' PRO . 10.8 tptp -97.69 -75.87 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.346 -178.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -89.89 -12.35 39.21 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.536 -168.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 p30 59.98 53.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.624 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 -168.55 1.44 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.78 157.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 1.1 mm-40 -110.17 155.4 22.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.518 0.675 . . . . 0.0 109.626 159.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 26.4 t -112.94 114.08 45.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.476 -157.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.04 156.0 39.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.376 177.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 15' ' ' ARG . 9.9 t80 -60.57 -59.4 5.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.904 -158.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.44 -0.77 13.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.571 -171.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -102.96 11.94 36.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.585 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.472 ' HD3' ' CD1' ' A' ' 12' ' ' PHE . 2.2 ptm180 -93.55 151.81 19.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.361 -160.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.982 HG21 HD22 ' A' ' 28' ' ' LEU . 15.9 m -145.75 145.58 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.494 155.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -115.22 135.45 54.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.635 -167.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.8 t -178.49 134.13 0.14 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.182 -168.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.55 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.2 mm? 59.96 18.62 7.71 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.656 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.23 -24.66 30.39 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 167.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mmpm? -110.1 159.18 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 114.815 -0.693 . . . . 0.0 110.107 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.93 176.5 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.289 -166.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 34.3 m95 -148.29 -179.97 7.33 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.184 -1.371 . . . . 0.0 109.106 -177.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -99.78 141.42 32.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.542 166.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.611 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.55 -49.44 86.96 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.177 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.611 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 9.8 Cg_endo -59.13 -30.4 93.07 Favored 'Trans proline' 0 N--CA 1.484 0.929 0 C-N-CA 122.456 2.104 . . . . 0.0 113.74 176.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -69.9 -45.35 67.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.277 -175.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 HG21 ' A' ' 16' ' ' VAL . 9.8 tp -64.91 84.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.325 -167.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -136.82 141.0 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.49 -169.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -67.78 124.12 22.44 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.445 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.85 42.72 1.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.237 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.537 ' HE3' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -140.52 -37.46 0.46 Allowed 'General case' 0 C--O 1.231 0.097 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.701 -178.287 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -117.52 -31.06 5.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.041 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.13 51.51 4.41 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -173.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.2 126.93 52.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.901 0.381 . . . . 0.0 110.116 164.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.4 m -61.25 133.57 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.228 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.538 HD13 ' HB2' ' A' ' 42' ' ' HIS . 92.1 mt -94.08 143.93 25.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.421 -163.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.874 HG22 ' H ' ' A' ' 40' ' ' GLY . 95.0 m -62.56 155.84 24.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.832 161.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.476 ' OG ' HG12 ' A' ' 16' ' ' VAL . 71.1 m -60.55 -21.07 62.14 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.083 178.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.874 ' H ' HG22 ' A' ' 38' ' ' THR . . . -121.76 179.69 16.19 Favored Glycine 0 CA--C 1.527 0.836 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.537 162.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.25 13.93 82.77 Favored Glycine 0 C--N 1.342 0.878 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.174 172.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.571 ' CE1' HD11 ' A' ' 28' ' ' LEU . 12.7 p80 -110.64 -167.33 1.17 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 113.967 -1.116 . . . . 0.0 110.468 169.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -170.51 160.36 7.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.151 159.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.55 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -114.88 122.46 46.37 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.213 -164.321 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.552 ' HB2' ' HG3' ' A' ' 48' ' ' LYS . 1.7 m80 -75.99 -168.25 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.877 160.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.39 85.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.027 -170.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.29 54.41 37.48 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -171.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.552 ' HG3' ' HB2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -168.04 105.52 0.56 Allowed Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.706 0.765 . . . . 0.0 109.935 170.35 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.556 ' HD2' ' CE ' ' A' ' 5' ' ' LYS . 14.0 Cg_endo -65.46 146.16 84.49 Favored 'Trans proline' 0 N--CA 1.484 0.92 0 C-N-CA 122.824 2.349 . . . . 0.0 113.624 169.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 22.4 m-85 -143.65 -166.05 2.24 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.843 168.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 94.5 m -57.49 129.71 43.03 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.748 -1.569 . . . . 0.0 110.278 165.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 23.0 t30 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.813 159.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.34 163.24 25.25 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.268 164.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.481 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -72.99 -19.13 15.7 Favored 'Cis proline' 0 C--N 1.352 0.746 0 C-N-CA 122.708 -1.788 . . . . 0.0 113.712 -11.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.1 m -59.1 -45.63 90.39 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.812 -155.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -61.17 -48.63 80.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.427 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.442 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -98.67 23.76 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.738 -172.002 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -113.13 -52.59 2.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.234 174.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.537 ' HG3' ' HE3' ' A' ' 32' ' ' LYS . 12.0 mmt -83.1 -44.69 14.85 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.827 174.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -98.27 -168.37 1.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.091 161.349 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.516 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 130.85 66.01 0.1 OUTLIER Glycine 0 CA--C 1.544 1.846 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 172.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.516 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 11.0 Cg_endo -58.86 174.2 0.94 Allowed 'Trans proline' 0 N--CA 1.485 1.02 0 C-N-CA 122.593 2.195 . . . . 0.0 113.498 169.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.17 -30.41 6.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.4 168.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.81 118.91 5.84 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 169.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -61.12 133.29 55.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.361 -0.419 . . . . 0.0 110.264 -169.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 63.41 -178.51 6.6 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 -170.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.33 107.76 10.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.374 170.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.97 131.22 3.54 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.38 -1.088 . . . . 0.0 110.38 -170.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -131.33 107.01 0.71 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -170.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -92.69 -71.49 0.65 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.259 169.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 58.53 111.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 168.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.7 t -171.0 34.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.459 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -175.22 108.44 0.1 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.348 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -118.06 -60.75 1.76 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.418 169.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.85 96.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.384 169.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.556 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.356 170.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.403 ' HD2' ' OD1' ' A' ' 22' ' ' ASP . 23.2 Cg_exo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 113.589 0.573 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.47 159.21 26.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.545 -166.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.0 t -88.04 118.78 70.03 Favored Pre-proline 0 C--O 1.25 1.131 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.221 -162.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.602 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.1 Cg_endo -58.81 -23.76 68.53 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.788 2.325 . . . . 0.0 113.14 169.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.79 -73.99 0.28 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.421 -176.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -94.42 -22.05 18.54 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.632 -164.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 71.93 61.6 0.14 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.556 -169.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.71 -167.76 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.058 162.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -103.36 147.66 26.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.299 163.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 49.1 t -109.46 111.97 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.68 -166.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.01 160.77 30.12 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.392 177.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.57 -63.02 1.44 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.75 -160.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.26 -11.0 60.59 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.71 -174.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.22 40.58 1.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.284 172.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.2 149.72 28.97 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.47 -176.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.496 HG21 HD22 ' A' ' 28' ' ' LEU . 18.3 m -143.47 145.71 22.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.475 155.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -113.81 139.5 49.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.546 -166.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.522 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 36.8 t -178.1 131.66 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.314 -171.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.621 HD21 ' OE1' ' A' ' 44' ' ' GLU . 3.1 mm? 59.99 18.82 7.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.551 -171.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.77 -24.47 26.04 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -105.33 157.72 17.13 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 114.808 -0.696 . . . . 0.0 110.026 179.262 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.403 ' OD1' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -92.16 177.47 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.299 -163.565 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.5 m95 -151.87 -175.13 5.1 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.067 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -101.16 144.83 29.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.474 169.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 34.6 tpt85 -61.62 -48.84 89.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.714 -170.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.4 Cg_endo -59.98 -31.71 93.96 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.597 2.198 . . . . 0.0 113.634 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -71.61 -44.99 63.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.278 -167.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.651 HD12 ' HG3' ' A' ' 49' ' ' PRO . 6.9 tp -66.48 77.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.441 -167.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -133.73 146.76 51.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.283 -173.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.9 t -60.19 128.81 38.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.403 169.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.501 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.2 mm-40 -99.85 26.13 6.61 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.129 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.561 ' HE2' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -114.82 -60.33 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.351 164.305 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.6 p -99.99 -20.41 16.1 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.766 -170.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.79 42.91 24.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 175.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.4 mmtt -119.04 130.01 55.41 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.988 -0.606 . . . . 0.0 110.373 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 m -61.43 149.85 37.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.449 -173.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.554 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 64.9 mt -110.63 125.59 53.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.378 -166.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -83.54 -166.84 1.49 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.705 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t -95.31 35.59 1.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.337 -165.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.49 58.44 0.01 OUTLIER Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 160.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -139.24 11.21 3.29 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 114.672 -0.764 . . . . 0.0 111.838 163.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.522 ' HE1' ' OG ' ' A' ' 18' ' ' SER . 26.9 p80 -113.46 -169.54 1.52 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.201 -0.5 . . . . 0.0 110.982 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -146.75 -166.86 2.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.816 -1.083 . . . . 0.0 110.05 168.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.621 ' OE1' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.38 134.83 33.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.168 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 86.4 t60 -114.46 162.52 16.57 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 161.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.453 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 50.5 mm-40 -60.06 90.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.332 -160.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.47 25.71 6.85 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 174.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.542 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 176.45 140.43 0.22 Allowed Pre-proline 0 C--O 1.242 0.705 0 CA-C-O 121.264 0.554 . . . . 0.0 109.778 161.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.651 ' HG3' HD12 ' A' ' 28' ' ' LEU . 13.6 Cg_endo -66.96 161.0 44.43 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 123.038 2.492 . . . . 0.0 113.609 164.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.542 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 65.0 m-85 -150.4 -173.88 4.59 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.881 168.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.8 m -58.12 132.52 53.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 113.789 -1.55 . . . . 0.0 110.159 161.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.442 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 14.0 t-20 -61.12 -33.2 73.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.882 164.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.479 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 31.7 m-70 -158.35 162.89 25.97 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.318 163.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.28 -18.18 16.81 Favored 'Cis proline' 0 C--N 1.353 0.81 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.646 -11.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 82.7 m -59.24 -43.14 92.41 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.907 -154.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.98 -61.31 2.67 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.376 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.479 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -64.19 -35.67 81.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.456 -174.001 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.16 -47.95 12.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.185 -167.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.561 ' HG2' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -94.36 -37.7 11.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.518 -162.256 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 0.2 OUTLIER -61.05 90.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.333 -164.323 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 175.19 166.72 33.36 Favored Glycine 0 CA--C 1.546 1.98 0 N-CA-C 109.494 -1.443 . . . . 0.0 109.494 -168.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -68.34 56.87 0.9 Allowed 'Trans proline' 0 N--CA 1.485 0.98 0 C-N-CA 122.732 2.288 . . . . 0.0 113.777 -166.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 1.5 tptt 60.28 27.32 16.84 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.619 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.61 92.98 0.07 OUTLIER Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -170.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 10.8 t80 175.59 -78.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.243 -0.479 . . . . 0.0 110.299 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.03 174.89 2.0 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 166.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 67' ' ' ARG . 0.4 OUTLIER -64.82 110.26 2.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.369 -0.416 . . . . 0.0 110.386 168.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -13.28 34.22 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.46 -131.49 10.81 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -178.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.27 106.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.31 169.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -77.52 -56.44 4.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.998 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p 61.43 -164.11 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.402 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.13 149.16 52.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.293 169.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 49.1 p -60.86 177.09 0.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.516 -169.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -72.95 -174.32 1.46 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.351 -169.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HA ' ' CE ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.647 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.372 170.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo . . . . . 0 N--CA 1.483 0.904 0 N-CA-C 113.595 0.575 . . . . 0.0 113.595 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.08 147.85 51.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.477 171.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -85.13 121.25 74.04 Favored Pre-proline 0 C--O 1.25 1.126 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.044 -166.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.595 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.22 -33.27 90.56 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 122.888 2.392 . . . . 0.0 113.097 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -63.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.42 -168.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -97.78 -24.17 15.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.749 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 t70 72.6 57.33 0.13 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.519 -171.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.32 -168.75 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.972 160.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -104.35 153.69 20.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.637 161.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 39.4 t -112.94 112.03 38.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.546 -163.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.487 ' CZ ' ' CE1' ' A' ' 12' ' ' PHE . 14.2 t80 -73.14 155.17 39.93 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.181 177.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.2 -59.44 5.41 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -158.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 -0.43 12.94 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.506 -172.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -105.81 17.81 23.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.353 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -96.3 152.09 18.91 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.249 -163.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.463 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -144.92 145.35 21.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.59 156.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -115.38 137.11 52.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.517 -165.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 t -178.46 128.04 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.247 -170.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.84 36.02 21.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.627 -171.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.12 17.9 53.39 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 168.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.69 156.49 47.36 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 164.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.18 176.69 6.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.319 -165.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.595 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 31.6 m95 -149.63 -176.84 5.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.12 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -99.93 146.5 26.6 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 113.954 -1.475 . . . . 0.0 110.585 168.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -61.02 -48.35 92.73 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.774 -168.234 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.3 Cg_endo -63.63 -35.31 59.4 Favored 'Trans proline' 0 N--CA 1.483 0.868 0 C-N-CA 122.555 2.17 . . . . 0.0 113.638 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.95 -50.73 65.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.209 -164.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.817 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -60.31 89.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.353 -163.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.494 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 57.3 mttt -148.69 149.81 32.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.393 -165.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.9 t -69.04 126.43 29.77 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.451 175.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.9 33.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.066 169.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' NZ ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -130.25 -49.53 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.198 179.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.447 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 29.3 p -113.5 -18.49 11.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.214 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.97 39.7 53.65 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -99.29 131.42 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.307 -0.447 . . . . 0.0 110.302 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 28.3 m -60.87 139.57 57.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.465 171.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 51.7 mt -103.07 121.75 43.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.359 -169.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -83.25 -169.08 2.36 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.48 -173.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.1 p -74.47 77.39 1.93 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.376 -167.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.42 56.1 1.72 Allowed Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 168.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.75 11.87 4.25 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 166.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.817 ' CE1' HD11 ' A' ' 28' ' ' LEU . 5.2 p80 -107.36 -170.32 1.68 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.106 -0.547 . . . . 0.0 110.451 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.87 158.7 10.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.833 163.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 17.8 pt-20 -112.77 128.33 56.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.211 -160.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.479 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.44 151.97 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.419 157.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -62.67 75.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.003 -172.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.449 ' HA3' ' NZ ' ' A' ' 48' ' ' LYS . . . 162.45 -53.52 0.31 Allowed Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.715 -167.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HG3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -155.16 140.48 12.37 Favored Pre-proline 0 C--O 1.242 0.68 0 CA-C-O 121.39 0.614 . . . . 0.0 110.048 -163.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.581 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.9 Cg_endo -68.46 149.35 74.64 Favored 'Trans proline' 0 N--CA 1.486 1.032 0 C-N-CA 123.08 2.52 . . . . 0.0 113.708 166.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 48' ' ' LYS . 8.4 m-85 -138.8 -173.65 3.62 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.79 167.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 86.0 m -57.52 134.59 56.24 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 113.458 -1.701 . . . . 0.0 110.348 164.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.88 -37.15 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.021 162.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.6 m-70 -152.68 169.82 9.04 Favored Pre-proline 0 CA--C 1.546 0.81 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 163.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.517 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 22.2 Cg_endo -66.12 -21.47 7.17 Favored 'Cis proline' 0 N--CA 1.491 1.347 0 C-N-CA 122.113 -2.036 . . . . 0.0 112.655 -19.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 73.4 m -57.11 -42.92 81.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.251 -153.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -61.03 -56.32 22.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.458 175.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.519 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -96.98 24.28 6.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.507 -166.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -122.11 -48.59 2.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.256 174.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.2 mmt -101.23 -18.36 16.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.506 -176.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -134.21 14.74 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.366 -165.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.24 160.58 42.4 Favored Glycine 0 CA--C 1.544 1.876 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -171.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -56.12 -18.92 24.95 Favored 'Trans proline' 0 N--CA 1.485 0.971 0 C-N-CA 122.702 2.268 . . . . 0.0 113.559 170.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt 58.84 -169.76 0.13 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.443 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.03 131.51 13.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 -169.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 67.8 162.68 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.349 168.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 172.89 57.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 170.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.8 158.3 30.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.395 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -166.89 -130.69 1.18 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -144.92 -86.05 0.07 OUTLIER Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -170.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -175.43 149.59 1.03 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.411 -0.395 . . . . 0.0 110.324 -169.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.46 139.29 58.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.959 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.99 124.62 21.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.37 -169.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -119.34 -66.6 1.05 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 93.1 m -94.71 139.7 30.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.395 170.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -95.03 145.09 25.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.284 -170.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.0 mmmm . . . . . 0 C--O 1.239 0.536 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.407 -170.063 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.428 ' HD2' ' OD2' ' A' ' 22' ' ' ASP . 5.3 Cg_exo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.59 158.77 29.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.355 -167.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.3 t -80.59 119.36 76.04 Favored Pre-proline 0 C--O 1.252 1.185 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.349 -161.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -61.1 -18.83 60.42 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.877 2.385 . . . . 0.0 113.198 167.852 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.452 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.9 OUTLIER -83.02 -77.65 0.24 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.424 -179.428 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -90.96 -20.12 22.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.918 -164.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 72.22 52.54 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.463 -173.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.81 -168.13 1.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.979 159.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 149.59 27.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.355 167.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.929 HG22 ' CD2' ' A' ' 24' ' ' HIS . 41.5 t -111.31 113.53 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.467 -161.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.4 ' HB3' ' CG ' ' A' ' 14' ' ' GLU . 1.4 t80 -77.7 158.75 29.53 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.457 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.11 -62.71 1.67 Allowed 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 -158.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.21 -13.29 61.87 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.813 -173.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HB3' ' A' ' 11' ' ' TYR . 1.9 pm0 -102.78 52.38 0.79 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.783 167.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -115.81 148.63 39.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.527 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.856 HG21 HD22 ' A' ' 28' ' ' LEU . 10.2 m -137.35 141.25 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.478 151.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.8 m -105.34 131.03 53.29 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.523 -176.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.411 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.0 OUTLIER -168.71 122.72 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.197 -164.167 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.654 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.17 32.97 21.08 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.77 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.93 18.5 78.71 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 163.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -154.72 160.05 41.1 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 164.372 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.428 ' OD2' ' HD2' ' A' ' 1' ' ' PRO . 1.0 OUTLIER -85.75 176.89 7.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.285 -165.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 23.6 m95 -152.91 -176.45 5.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.03 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.929 ' CD2' HG22 ' A' ' 10' ' ' VAL . 39.2 m80 -101.76 142.26 33.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.476 168.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -61.16 -50.59 83.47 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.732 -169.469 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 7.3 Cg_exo -57.38 -34.93 98.75 Favored 'Trans proline' 0 N--CA 1.483 0.9 0 C-N-CA 122.618 2.212 . . . . 0.0 113.545 174.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.8 m -65.74 -46.47 78.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.352 -169.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.857 HD21 ' CE1' ' A' ' 42' ' ' HIS . 11.3 tp -60.84 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.332 -165.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -139.73 146.63 39.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.327 -164.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 3.0 t -70.66 119.77 15.3 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 167.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -97.71 29.03 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.988 165.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HD2' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tptp -110.48 -52.35 2.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.116 170.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.8 -24.36 10.91 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.752 -177.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.72 44.62 7.17 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 2.4 mmtm -111.15 119.82 40.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.306 -0.447 . . . . 0.0 110.401 168.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.5 m -61.08 161.72 8.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.319 168.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.879 HD13 ' HB2' ' A' ' 42' ' ' HIS . 5.0 mt -131.78 147.32 52.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.351 -165.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -83.47 -166.2 1.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.586 174.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.0 t -95.76 32.11 1.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.346 -169.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 167.22 57.36 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 164.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.25 12.0 2.29 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 114.763 -0.718 . . . . 0.0 111.825 170.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.879 ' HB2' HD13 ' A' ' 37' ' ' LEU . 2.3 p80 -112.75 -174.62 2.49 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.47 -175.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -152.62 -177.27 6.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 164.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.547 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.9 mp0 -140.72 114.77 9.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.059 -164.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.497 ' CD2' ' CE2' ' A' ' 60' ' ' PHE . 1.3 m80 -74.0 -167.84 0.54 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.821 157.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.39 86.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.199 -173.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.25 47.34 91.58 Favored Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.734 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.9 103.26 1.93 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 121.851 0.834 . . . . 0.0 109.848 -175.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HA ' ' O ' ' A' ' 43' ' ' ALA . 12.3 Cg_endo -66.87 145.2 73.76 Favored 'Trans proline' 0 N--CA 1.484 0.962 0 C-N-CA 122.594 2.196 . . . . 0.0 113.79 177.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -143.63 -168.32 2.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.848 171.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 69.2 m -57.51 134.56 56.2 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.197 161.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -61.28 -33.48 73.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.89 160.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.535 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 23.6 m-70 -157.13 163.81 23.78 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.193 164.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.3 Cg_endo -73.2 -17.42 17.31 Favored 'Cis proline' 0 C--N 1.354 0.828 0 C-N-CA 122.627 -1.822 . . . . 0.0 113.558 -14.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.3 m -59.5 -38.06 79.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.723 -155.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.489 ' CE2' ' CD2' ' A' ' 60' ' ' PHE . 42.0 t80 -62.35 -54.8 35.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.385 168.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.535 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.0 t -61.83 -12.69 18.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.464 -173.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.09 -40.67 12.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.287 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -38.92 20.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.407 -179.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.497 ' CE2' ' CD2' ' A' ' 45' ' ' HIS . 37.3 m-85 -98.94 92.31 5.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.435 -168.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.48 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 120.19 69.74 0.3 Allowed Glycine 0 CA--C 1.542 1.728 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 169.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.48 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 1.7 Cg_endo -57.7 -23.13 56.22 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.502 2.135 . . . . 0.0 113.552 170.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -73.52 0.39 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.46 172.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 61.09 31.22 75.91 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 170.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -109.88 171.58 7.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.042 -0.579 . . . . 0.0 110.309 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.64 90.82 2.12 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 -170.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.499 ' NH1' ' HB2' ' A' ' 71' ' ' GLU . 10.0 tpt180 64.87 142.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.438 -170.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.02 90.22 1.85 Allowed Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -170.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.15 44.11 0.22 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 177.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.26 99.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.351 -0.425 . . . . 0.0 110.274 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' HB2' ' NH1' ' A' ' 67' ' ' ARG . 2.6 tt0 -94.23 117.92 30.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.04 169.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.3 p -64.4 -164.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.406 169.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.7 m170 68.67 25.79 6.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.295 -170.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.517 HG23 ' HG2' ' A' ' 76' ' ' LYS . 5.5 t -105.57 160.62 15.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.389 169.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -95.9 26.15 4.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.26 -169.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.517 ' HG2' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.24 0.595 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.349 170.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.099 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -131.11 156.41 45.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.432 170.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.1 t -83.09 118.93 73.18 Favored Pre-proline 0 C--O 1.25 1.086 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.435 -162.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.6 Cg_endo -60.15 -19.62 57.66 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.754 2.303 . . . . 0.0 113.373 167.806 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.08 -77.29 0.23 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.466 179.519 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.58 -19.74 21.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.725 -163.256 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 16.2 t70 71.78 64.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.455 -170.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -126.08 -168.01 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.167 162.722 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -103.93 148.83 25.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.289 163.759 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 56.1 t -115.92 110.95 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.723 -164.036 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.496 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 27.0 t80 -72.74 154.95 40.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.374 -179.314 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.496 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 15.9 m-85 -60.28 -61.38 2.64 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.945 -158.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.78 -1.18 13.1 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.613 -173.015 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -102.4 12.17 36.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.547 178.046 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -97.11 158.19 15.56 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.178 -160.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.818 HG21 HD22 ' A' ' 28' ' ' LEU . 17.7 m -146.53 145.94 19.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.471 156.386 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -114.39 137.42 51.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 114.904 -1.043 . . . . 0.0 110.669 -166.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.0 t -178.35 127.48 0.12 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.235 -171.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 59.94 34.87 21.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.557 -170.172 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.75 18.0 51.51 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.541 -1.023 . . . . 0.0 110.541 169.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.44 153.15 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 164.674 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.427 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.7 OUTLIER -89.68 177.17 6.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.289 -165.535 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 26.1 m95 -150.39 175.56 11.73 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.064 -1.425 . . . . 0.0 109.383 -177.705 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.8 m80 -93.37 137.64 32.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.526 171.144 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.56 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 ttp180 -61.03 -46.43 96.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.83 -170.693 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.5 Cg_exo -50.36 -48.32 20.61 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.704 2.269 . . . . 0.0 113.496 166.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.77 -51.53 67.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.231 -166.376 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.818 HD22 HG21 ' A' ' 16' ' ' VAL . 3.2 tp -60.24 91.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.404 -162.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.7 mtpt -140.96 154.18 45.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.357 -169.372 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.0 t -69.45 132.05 45.72 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.376 176.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HB2' ' CZ ' ' A' ' 50' ' ' TYR . 45.1 mm-40 -95.43 31.31 2.01 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 114.194 -1.367 . . . . 0.0 110.261 173.437 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.33 -48.54 0.53 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.189 -174.343 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.1 p -114.1 -10.74 12.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.245 178.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 70.41 23.35 77.56 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 172.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -103.74 136.23 43.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.911 -0.645 . . . . 0.0 110.402 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 m -61.94 142.56 57.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.451 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.533 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 60.1 mt -99.92 157.77 16.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.422 -173.082 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -101.9 -172.39 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.221 -167.748 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER -60.98 -22.09 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.445 -167.59 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 174.68 60.76 0.05 OUTLIER Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 170.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -115.2 11.61 19.8 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 166.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.527 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.1 p80 -102.04 -168.61 1.56 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.389 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -167.36 158.64 11.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.958 161.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.576 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -121.18 138.99 53.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.1 -163.632 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.468 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 38.6 t60 -130.43 109.21 10.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.76 173.503 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.488 ' HB3' ' HD2' ' A' ' 48' ' ' LYS . 1.4 tp10 58.4 43.34 19.91 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.663 -170.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.84 22.65 73.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -117.64 98.43 51.7 Favored Pre-proline 0 C--O 1.243 0.736 0 CA-C-N 115.159 -0.52 . . . . 0.0 109.759 173.195 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.533 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.7 Cg_endo -64.33 155.18 67.14 Favored 'Trans proline' 0 N--CA 1.483 0.887 0 C-N-CA 122.62 2.213 . . . . 0.0 113.572 -173.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 31' ' ' GLU . 76.3 m-85 -151.6 177.63 10.15 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.001 175.431 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 97.0 m -56.52 132.08 50.46 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.379 -1.737 . . . . 0.0 110.426 161.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.64 -30.06 69.64 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.978 163.332 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.474 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 34.4 m-70 -160.87 165.17 17.76 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.699 -1.137 . . . . 0.0 109.323 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.474 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.0 Cg_endo -72.89 -15.0 17.89 Favored 'Cis proline' 0 N--CA 1.483 0.898 0 C-N-CA 122.628 -1.822 . . . . 0.0 113.608 -13.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 77.6 m -59.54 -44.34 93.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.714 -157.02 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -61.78 -51.0 70.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.517 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.447 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -73.79 -15.25 61.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.342 -176.219 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.56 -56.03 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.354 173.421 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.3 tpt -72.1 -46.49 56.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.39 -170.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 18.0 m-85 -102.03 93.25 5.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.325 -171.665 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -138.02 141.26 11.94 Favored Glycine 0 CA--C 1.542 1.735 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -52.1 156.4 7.57 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 C-N-CA 122.571 2.181 . . . . 0.0 113.555 -176.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' H ' ' HG3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.6 -54.4 2.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.321 169.785 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.6 -162.07 34.68 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -145.48 -80.39 0.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.167 -0.516 . . . . 0.0 110.364 -177.279 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.8 45.91 95.55 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 170.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.25 -80.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.195 -0.502 . . . . 0.0 110.356 -175.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.43 -88.63 0.65 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 170.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -163.77 169.23 38.66 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 -170.249 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.97 -14.55 15.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.152 -0.524 . . . . 0.0 110.311 176.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 58.59 -159.44 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.635 168.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.6 t 65.88 90.94 0.09 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.349 -168.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' N ' ' CD2' ' A' ' 73' ' ' HIS . 0.2 OUTLIER -157.41 79.79 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.379 170.263 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.0 p -96.16 -18.02 20.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.413 -178.052 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -111.23 -53.07 2.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.34 169.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.387 -170.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.437 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 8.7 Cg_exo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.5 0.538 . . . . 0.0 113.5 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HD3' ' HG2' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -119.52 155.99 31.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.413 -167.414 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.0 t -83.7 119.42 73.64 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.417 -164.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.6 Cg_endo -62.0 -17.78 57.87 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.794 2.329 . . . . 0.0 113.261 167.547 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.485 ' HD2' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -83.27 -76.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.449 179.593 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -92.79 -20.25 20.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.825 -163.19 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 t0 72.46 59.51 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.468 -171.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.53 -176.35 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.993 160.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.416 ' HG2' ' HD3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER -98.26 148.0 24.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.528 172.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.1 t -111.96 112.96 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.546 -158.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 19.1 t80 -73.14 151.44 41.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.41 -179.343 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -60.41 -54.63 43.34 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.875 -159.211 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.91 -1.22 27.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.522 -170.115 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 13.22 28.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.339 175.73 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.45 153.49 22.45 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.283 -165.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 18.0 m -147.84 147.57 17.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.787 156.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -113.84 136.06 53.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.666 -168.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.1 t -177.74 131.33 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.417 -173.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.607 HD23 ' HG2' ' A' ' 44' ' ' GLU . 3.1 mm? 60.12 36.0 21.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.719 -175.918 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.11 18.59 67.13 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.9 157.84 43.88 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 165.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.437 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 4.1 m-20 -89.78 176.7 6.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.29 -168.344 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 25.5 m95 -149.49 179.13 8.2 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.101 -177.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -96.27 142.99 27.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.445 170.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.568 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 15.0 tpt180 -61.28 -45.22 95.15 Favored Pre-proline 0 CA--C 1.543 0.689 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.728 -166.369 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.5 Cg_endo -64.81 -37.17 36.48 Favored 'Trans proline' 0 N--CA 1.483 0.893 0 C-N-CA 122.586 2.191 . . . . 0.0 113.604 175.107 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.485 ' HB3' ' HD2' ' A' ' 5' ' ' LYS . 1.4 m -61.08 -48.31 82.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.208 -166.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.483 HD22 HG21 ' A' ' 16' ' ' VAL . 6.6 tp -60.4 89.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.425 -163.319 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.513 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 mttt -143.46 144.06 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.3 -165.595 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.6 t -63.25 119.52 9.78 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.47 167.413 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 6.9 pt-20 -97.22 35.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.758 164.037 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HE2' ' HE2' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -120.35 -48.71 2.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.205 173.161 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 32.1 p -112.6 -22.71 10.63 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 114.541 -1.208 . . . . 0.0 110.994 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.27 42.81 9.06 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 -178.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -97.65 133.63 41.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.364 169.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.503 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 14.0 m -69.06 143.17 54.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.313 167.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.828 HD13 ' HB2' ' A' ' 42' ' ' HIS . 85.0 mt -109.19 158.88 17.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.262 -167.478 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.7 t -116.74 -169.05 1.56 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.549 -166.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.9 t -60.84 -23.1 64.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 -165.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.88 70.69 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -136.27 22.45 3.39 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 163.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.828 ' HB2' HD13 ' A' ' 37' ' ' LEU . 8.0 p80 -111.33 -168.43 1.31 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 114.792 -0.704 . . . . 0.0 110.486 -177.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -147.87 -166.64 2.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.776 165.661 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.607 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -163.13 137.81 6.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.077 162.624 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 85.6 t60 -103.09 112.68 25.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.831 166.053 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 58.28 31.7 21.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.742 165.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 116.35 -20.12 12.66 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.579 -1.008 . . . . 0.0 110.579 170.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -104.92 94.21 7.3 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 121.408 0.623 . . . . 0.0 109.853 -169.175 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.3 Cg_endo -64.44 158.07 51.37 Favored 'Trans proline' 0 N--CA 1.485 1.003 0 C-N-CA 122.374 2.05 . . . . 0.0 113.597 -177.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 88.2 m-85 -155.4 -164.6 1.8 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.074 174.304 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 98.1 m -56.48 135.52 54.31 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.435 161.458 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -61.12 -30.92 70.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.885 161.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.536 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 29.8 m-70 -161.65 164.97 17.21 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.333 165.915 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 11.2 Cg_endo -72.3 -15.24 16.79 Favored 'Cis proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.529 -1.863 . . . . 0.0 113.555 -14.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.68 -40.34 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.657 -156.645 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -60.98 -35.61 77.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.471 172.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 16.1 t -84.58 -13.54 51.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.338 -174.295 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.78 -40.52 13.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.229 -177.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.34 -47.01 7.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.451 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 16.2 m-85 -120.37 100.59 7.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.341 -169.562 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -147.44 -136.71 2.84 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.29 -20.94 4.04 Favored 'Trans proline' 0 N--CA 1.485 0.98 0 C-N-CA 122.511 2.141 . . . . 0.0 113.549 171.401 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -166.94 168.44 13.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.435 168.801 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -160.61 -142.6 3.43 Favored Glycine 0 CA--C 1.527 0.781 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -169.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.1 -76.99 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.368 -0.416 . . . . 0.0 110.37 170.268 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 90.51 -85.05 1.33 Allowed Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 170.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.16 96.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.418 169.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.54 85.77 0.29 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 178.247 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 138.28 -64.63 0.55 Allowed Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 170.238 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.73 -82.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.443 -0.378 . . . . 0.0 110.315 -169.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.88 157.54 18.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.073 168.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.7 t -91.83 -68.99 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.323 -169.273 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -127.85 -173.03 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.406 -169.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.98 87.76 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.422 -170.092 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -118.63 100.29 7.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.344 170.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? . . . . . 0 C--O 1.241 0.613 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.291 -170.087 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.584 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 7.1 Cg_exo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 113.528 0.549 . . . . 0.0 113.528 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -147.05 136.47 22.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.485 -166.458 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.1 t -93.52 118.77 67.6 Favored Pre-proline 0 C--O 1.247 0.957 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.157 -167.741 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.66 -27.43 84.81 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.839 2.359 . . . . 0.0 113.196 168.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -73.02 0.19 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.388 -176.441 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.14 -16.2 22.77 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.242 -165.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.23 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.569 -169.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 -167.82 1.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.01 158.332 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.31 145.58 30.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.379 165.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 48.5 t -107.71 110.25 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.746 -165.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -73.8 157.4 36.47 Favored 'General case' 0 N--CA 1.457 -0.1 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -60.66 -63.13 1.4 Allowed 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.763 -160.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -3.83 19.3 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.372 -1.286 . . . . 0.0 111.79 -174.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.18 16.1 26.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 178.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -97.69 149.64 22.06 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.28 -163.543 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.781 HG21 HD22 ' A' ' 28' ' ' LEU . 12.5 m -142.2 119.07 6.83 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.483 154.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 63.7 m -88.05 133.36 33.99 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.287 -176.528 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.517 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 0.5 OUTLIER -160.9 120.67 2.69 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.337 -161.047 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.624 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.7 mm? 60.02 18.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.721 -177.641 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.21 -26.11 12.77 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 162.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.77 147.49 43.82 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.873 -0.663 . . . . 0.0 109.95 178.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -79.06 177.51 8.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.191 -163.264 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 46.2 m95 -151.46 -178.32 6.6 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 113.972 -1.467 . . . . 0.0 109.371 -177.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.1 m80 -98.49 145.59 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.488 171.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -62.62 -49.9 80.82 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.833 -173.512 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.7 Cg_exo -61.56 -32.28 87.69 Favored 'Trans proline' 0 N--CA 1.482 0.835 0 C-N-CA 122.744 2.296 . . . . 0.0 113.604 176.506 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.6 m -70.2 -49.49 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.149 -168.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.905 HD21 ' NE2' ' A' ' 42' ' ' HIS . 5.3 tp -64.51 82.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.329 -162.771 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -124.24 142.47 51.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.301 -170.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.6 t -63.24 128.62 36.67 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.37 170.533 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG3' ' HG2' ' A' ' 48' ' ' LYS . 4.9 mm-40 -95.81 37.32 1.22 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.159 169.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.38 -50.39 0.56 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.257 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -112.19 -18.75 12.48 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.043 -179.738 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.42 40.27 60.33 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 174.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -111.88 134.98 53.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.154 -0.523 . . . . 0.0 110.495 171.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.2 m -61.56 147.13 46.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.381 176.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 11.4 mt -109.23 170.25 8.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.355 -166.907 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 39' ' ' SER . 1.3 m -108.01 174.57 5.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.424 -165.404 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.442 ' H ' HG22 ' A' ' 38' ' ' THR . 7.1 t -64.98 69.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.371 171.118 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.71 55.42 1.65 Allowed Glycine 0 CA--C 1.531 1.045 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 171.118 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.3 12.84 5.74 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.589 -0.605 . . . . 0.0 111.589 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.905 ' NE2' HD21 ' A' ' 28' ' ' LEU . 3.2 p80 -115.14 -168.93 1.46 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.781 -0.71 . . . . 0.0 110.257 -177.609 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.67 157.78 12.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.894 161.403 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.574 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -112.46 128.68 56.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.007 -163.851 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.459 ' CG ' ' H ' ' A' ' 46' ' ' GLU . 86.3 t60 -90.37 163.4 14.72 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.303 160.857 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.459 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 2.1 tt0 -60.43 92.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.119 -161.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.71 54.67 11.53 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.63 -169.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -179.74 101.84 0.18 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-O 121.451 0.643 . . . . 0.0 109.884 166.953 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.574 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 11.9 Cg_endo -65.1 150.25 88.06 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.803 2.335 . . . . 0.0 113.639 170.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 47.5 m-85 -147.61 -179.57 6.97 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.914 169.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 93.9 m -56.28 140.89 43.4 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.295 -1.775 . . . . 0.0 110.592 164.239 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -61.01 -32.95 72.52 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.12 168.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 54' ' ' PRO . 33.5 m-70 -162.73 165.63 14.84 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.339 166.362 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.472 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -71.5 -11.33 15.39 Favored 'Cis proline' 0 C--N 1.354 0.831 0 C-N-CA 122.52 -1.866 . . . . 0.0 113.616 -14.344 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.4 m -59.82 -45.75 91.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 -157.842 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -61.28 -65.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.275 -178.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.447 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 73.1 m -65.27 -12.84 55.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.47 -170.237 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.58 -54.73 5.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.426 171.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -54.18 10.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.369 -169.258 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 45' ' ' HIS . 41.6 m-85 -114.17 99.42 7.61 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.327 -177.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.01 -61.63 0.19 Allowed Glycine 0 CA--C 1.542 1.741 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 172.566 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 57' ' ' SER . 8.0 Cg_exo -60.65 -7.06 6.59 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 122.56 2.173 . . . . 0.0 113.495 -169.887 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -17.64 56.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.375 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.93 143.59 0.13 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 169.79 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -159.29 -52.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.282 -0.459 . . . . 0.0 110.308 170.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 177.36 177.13 46.01 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 170.323 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -115.49 163.05 16.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.352 -0.424 . . . . 0.0 110.333 -170.134 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.87 174.45 51.35 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -170.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 148.62 -22.86 1.33 Allowed Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -170.403 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.54 -168.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.277 169.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -115.39 77.92 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.052 -168.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.58 97.62 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.253 -169.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -71.67 -35.7 70.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.421 179.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.1 p -67.12 -85.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.439 -170.225 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -158.54 -73.78 0.08 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.436 -169.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.655 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.316 178.21 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.88 148.12 49.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.36 -171.386 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.3 t -76.09 118.33 70.44 Favored Pre-proline 0 C--O 1.246 0.906 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.505 -163.469 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.601 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.4 Cg_exo -60.22 -18.62 53.03 Favored 'Trans proline' 0 N--CA 1.489 1.21 0 C-N-CA 122.96 2.44 . . . . 0.0 113.211 167.295 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -84.99 -77.4 0.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.46 -178.14 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.8 p -89.87 -13.07 37.21 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.455 -167.231 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 60.2 54.59 3.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.574 -173.16 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.465 ' HA ' ' HD2' ' A' ' 8' ' ' LYS . 6.5 tptp -108.47 -168.37 1.35 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.767 157.081 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.96 155.3 18.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.595 161.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 38.7 t -114.24 113.28 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.504 -163.66 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.426 ' CE1' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t80 -73.35 157.79 36.3 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.359 177.076 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CE2' ' CE1' ' A' ' 11' ' ' TYR . 5.8 m-85 -60.55 -61.89 2.26 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.77 -159.819 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.38 -1.22 9.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.616 -173.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.557 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 15.8 mm-40 -101.96 12.98 36.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.69 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.24 152.12 18.64 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.277 -160.295 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG21 HD22 ' A' ' 28' ' ' LEU . 16.7 m -145.91 150.04 15.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.662 156.379 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 138.84 44.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.816 -170.677 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.453 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 27.8 t -177.3 132.76 0.17 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.341 178.007 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.634 HD23 ' OE1' ' A' ' 44' ' ' GLU . 3.4 mm? 60.15 38.0 20.51 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.533 -175.536 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.36 18.67 63.42 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 166.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -145.19 158.89 43.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.595 -0.302 . . . . 0.0 110.2 166.398 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.14 177.15 6.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.374 -167.729 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.601 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.84 -174.71 4.78 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 114.162 -1.381 . . . . 0.0 108.993 -177.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.0 m80 -100.9 142.38 32.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 113.803 -1.544 . . . . 0.0 110.555 170.136 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.6 ' HD3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.23 -44.81 94.67 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.116 -174.211 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.6 ' HD3' ' HD3' ' A' ' 25' ' ' ARG . 6.0 Cg_endo -62.65 -28.65 77.03 Favored 'Trans proline' 0 N--CA 1.484 0.925 0 C-N-CA 122.503 2.135 . . . . 0.0 113.652 175.417 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.32 -50.85 11.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.294 -168.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.572 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.4 tp -65.2 75.78 0.05 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.301 -177.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 8.6 ttmt -147.52 139.54 24.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.431 -174.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.8 t -61.19 125.67 24.58 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.317 178.217 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HE1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -100.7 21.8 12.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.13 172.91 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.47 ' HD2' ' HE1' ' A' ' 59' ' ' MET . 0.0 OUTLIER -104.4 -58.6 1.86 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.162 166.063 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.404 ' HA ' ' HZ1' ' A' ' 32' ' ' LYS . 31.5 p -102.31 -33.34 9.63 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.407 -172.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.51 49.51 4.6 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.506 178.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.515 ' HB2' ' NZ ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -106.59 126.87 52.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.157 0.503 . . . . 0.0 110.417 161.352 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.55 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 67.7 m -61.86 136.33 57.94 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.176 172.162 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 42' ' ' HIS . 34.3 mt -96.43 165.91 11.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.371 -160.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 39' ' ' SER . 2.0 m -112.12 177.93 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.296 -164.076 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 38' ' ' THR . 48.8 m -60.72 84.04 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.526 170.215 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 55.79 7.31 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 172.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -132.03 12.23 5.32 Favored Glycine 0 CA--C 1.524 0.651 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.608 162.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.572 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.3 p80 -105.48 -168.53 1.47 Allowed 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 114.72 -0.74 . . . . 0.0 110.399 177.336 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.517 ' HB2' HD22 ' A' ' 52' ' ' ASN . . . -168.66 157.58 8.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.804 160.079 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.634 ' OE1' HD23 ' A' ' 19' ' ' LEU . 5.7 pt-20 -120.83 125.48 47.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.131 -161.576 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 83.4 t60 -93.4 164.65 13.12 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 158.178 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.472 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 15.3 mm-40 -58.09 93.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 -157.124 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.0 56.38 5.82 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.746 -172.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HE2' ' NZ ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER 179.14 98.86 0.17 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-O 121.755 0.788 . . . . 0.0 110.02 163.009 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.471 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 32.5 Cg_endo -68.52 137.84 40.41 Favored 'Trans proline' 0 N--CA 1.485 1.022 0 C-N-CA 122.974 2.449 . . . . 0.0 113.503 166.06 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 11.9 m-85 -133.85 -163.8 1.41 Allowed 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.67 171.383 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 91.9 m -56.37 134.16 53.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.451 163.521 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.517 HD22 ' HB2' ' A' ' 43' ' ' ALA . 5.3 t-20 -60.93 -31.11 70.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.024 163.539 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.497 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 19.4 m-70 -158.62 166.39 16.57 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.206 164.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -66.26 -21.71 7.22 Favored 'Cis proline' 0 N--CA 1.49 1.276 0 C-N-CA 121.992 -2.087 . . . . 0.0 112.733 -20.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.9 m -56.54 -39.12 72.86 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.386 -152.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -64.73 -71.84 0.17 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.033 174.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.497 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 20.4 m -62.41 -14.16 37.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.54 -166.505 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.2 -50.92 5.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.236 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HE1' ' HD2' ' A' ' 32' ' ' LYS . 4.2 mtm -98.84 -34.07 10.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.505 -161.155 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.515 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -73.71 87.29 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.386 -166.31 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.492 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -176.48 48.42 0.11 Allowed Glycine 0 CA--C 1.546 1.987 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 172.323 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.492 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 10.6 Cg_endo -63.24 -86.13 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.672 2.248 . . . . 0.0 113.641 -168.381 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HE2' ' CZ ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER 64.84 -75.44 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.414 -166.11 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.12 119.41 0.01 OUTLIER Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -176.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.455 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 41.5 m-85 -111.08 26.21 10.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.444 -0.378 . . . . 0.0 110.282 -169.453 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.28 -65.52 0.5 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 169.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -23.34 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.27 -0.465 . . . . 0.0 110.439 -170.414 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.95 -140.45 6.6 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 179.266 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 104.75 -94.6 1.04 Allowed Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -171.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.511 ' HB1' ' OE2' ' A' ' 71' ' ' GLU . . . 61.62 117.29 0.02 OUTLIER 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.319 170.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.511 ' OE2' ' HB1' ' A' ' 70' ' ' ALA . 0.0 OUTLIER 59.09 130.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.734 178.136 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.4 p -108.61 117.9 35.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.336 -169.039 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -111.29 144.7 40.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.337 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.534 HG22 ' CE2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -61.14 -81.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.412 -169.755 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.534 ' CE2' HG22 ' A' ' 74' ' ' THR . 1.1 p90 -152.2 140.72 20.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.411 178.023 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.591 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.359 -170.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.491 0.535 . . . . 0.0 113.491 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.4 149.0 47.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.29 169.488 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.1 t -83.55 117.27 68.17 Favored Pre-proline 0 C--O 1.249 1.047 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.221 -162.347 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.5 Cg_endo -59.46 -23.08 69.1 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.418 2.079 . . . . 0.0 113.069 169.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HG2' ' HD2' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -77.51 -72.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.545 -175.44 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.34 -20.45 19.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.755 -165.788 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 72.78 57.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.506 -172.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -118.57 -168.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.92 159.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -104.35 154.14 20.19 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.434 160.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 31.7 t -112.27 111.99 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.45 -162.21 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.57 33.1 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.554 -1.203 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -51.21 70.81 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.007 -156.453 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -0.37 29.33 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.444 -168.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -111.05 20.96 16.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.304 173.084 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.84 148.0 24.86 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.355 -169.717 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.95 117.53 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.661 154.256 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -97.34 142.58 29.04 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.521 -173.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.6 t -177.26 137.36 0.22 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.212 -169.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 4.7 mp 60.13 16.4 5.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.553 -172.874 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.6 -25.82 23.24 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 165.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.94 149.72 41.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 114.721 -0.739 . . . . 0.0 110.158 -178.135 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -85.76 177.53 7.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.217 -162.611 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.607 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 42.2 m95 -149.18 -175.84 5.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.376 179.27 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.6 m80 -98.22 148.52 23.52 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.468 173.389 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 tpp85 -61.58 -45.25 93.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.716 -168.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.0 Cg_endo -66.17 -40.28 15.87 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 122.538 2.159 . . . . 0.0 113.581 174.674 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.61 -53.26 59.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.301 -163.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 37' ' ' LEU . 1.6 tp -60.51 91.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.414 -163.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 mtmp? -152.18 148.05 27.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.353 -170.375 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 8.9 t -61.63 126.87 28.87 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.485 173.369 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.74 21.29 11.61 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.163 176.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.13 -61.25 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.358 165.952 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.0 p -100.54 -22.76 14.88 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.569 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.53 45.18 11.34 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.537 -1.025 . . . . 0.0 110.537 -175.842 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -99.99 120.98 40.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.463 . . . . 0.0 110.298 165.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.5 m -61.23 131.0 49.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.302 175.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 28' ' ' LEU . 21.3 mt -94.57 118.08 31.13 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 114.618 -1.173 . . . . 0.0 110.38 -174.024 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -60.15 -168.46 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.549 169.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -87.15 69.1 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.245 165.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 156.01 151.7 6.0 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.651 176.107 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.06 15.42 81.11 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.107 -1.044 . . . . 0.0 111.355 167.06 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.654 ' HB2' HD13 ' A' ' 37' ' ' LEU . 21.5 p80 -110.83 -166.51 1.08 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.722 -0.739 . . . . 0.0 110.853 172.343 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.452 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -168.95 159.63 9.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.191 -170.964 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.539 ' HG3' ' CH2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -135.63 122.53 21.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.006 -165.092 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -128.86 102.15 6.41 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.197 -1.365 . . . . 0.0 109.972 177.037 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 58.6 47.47 13.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.643 -171.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.87 19.87 56.53 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.578 173.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HA ' ' HZ1' ' A' ' 5' ' ' LYS . 12.9 mmtm -110.4 98.38 35.92 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 170.347 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.616 ' HB2' HD12 ' A' ' 37' ' ' LEU . 9.7 Cg_endo -62.17 157.82 42.78 Favored 'Trans proline' 0 N--CA 1.486 1.042 0 C-N-CA 122.47 2.113 . . . . 0.0 113.638 -173.14 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 57.0 m-85 -158.32 173.55 16.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.994 -170.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.4 m -57.87 130.88 48.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.051 160.201 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -61.52 -31.91 71.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.81 160.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 24.5 m-70 -157.12 163.2 25.82 Favored Pre-proline 0 CA--C 1.553 1.076 0 CA-C-N 114.757 -1.11 . . . . 0.0 109.162 165.07 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.428 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.71 -16.73 18.65 Favored 'Cis proline' 0 C--N 1.353 0.788 0 C-N-CA 122.665 -1.806 . . . . 0.0 113.651 -13.316 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.6 m -59.36 -44.99 92.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.711 -156.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -60.83 -52.73 63.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.507 174.456 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.472 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 7.6 t -63.31 -29.15 70.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.38 -173.421 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.09 20.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -170.524 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.8 mmt -101.49 -39.28 7.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.508 -171.201 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -113.06 81.65 1.53 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 178.008 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -136.64 -165.67 10.59 Favored Glycine 0 CA--C 1.542 1.725 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -172.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -61.51 73.07 0.09 OUTLIER 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.565 2.176 . . . . 0.0 113.597 -177.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.27 84.95 1.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.393 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.32 43.51 1.67 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 174.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.488 ' CZ ' ' NH1' ' A' ' 67' ' ' ARG . 0.1 OUTLIER 176.81 -170.04 0.07 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.422 -0.389 . . . . 0.0 110.332 -168.829 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.9 108.96 0.91 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 169.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.488 ' NH1' ' CZ ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER 179.54 98.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.371 -0.415 . . . . 0.0 110.366 -170.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 170.14 -124.28 1.13 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 170.402 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 76.97 119.52 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -170.324 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.38 -52.87 62.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.218 -170.042 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -117.92 -158.42 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.962 -169.167 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 p -111.44 -170.93 1.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.422 -167.377 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 18.1 m80 62.28 78.34 0.29 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.431 -170.24 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.0 m -150.36 -86.35 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.179 174.111 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -129.61 -79.49 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.19 165.049 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.24 0.564 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.344 165.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.466 ' H2 ' ' HD2' ' A' ' 2' ' ' LYS . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.946 0 N-CA-C 113.608 0.58 . . . . 0.0 113.608 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -115.55 158.2 22.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.379 -168.619 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.8 t -86.84 122.75 71.3 Favored Pre-proline 0 C--O 1.247 0.972 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.165 -162.445 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.62 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.5 Cg_endo -62.03 -30.18 82.59 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.846 2.364 . . . . 0.0 113.288 168.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -70.87 0.28 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.476 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.0 p -96.65 -14.22 22.27 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.485 -166.307 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.5 57.12 3.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.58 -169.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.71 -168.01 1.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.853 158.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -107.69 152.14 24.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.608 162.013 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' CD2' ' A' ' 24' ' ' HIS . 42.9 t -111.2 112.47 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.615 -163.636 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.35 152.98 44.65 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.308 175.596 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -60.52 3.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.777 -158.759 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.53 -11.8 61.05 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.744 -172.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.426 ' H ' ' HG2' ' A' ' 14' ' ' GLU . 3.9 pt-20 -102.81 42.6 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.173 170.984 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -108.82 152.72 24.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.384 -178.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.536 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -143.73 145.72 21.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.602 155.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.7 136.48 50.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.668 -166.204 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.422 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 28.0 t -177.99 136.45 0.17 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.466 -173.573 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.435 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.3 mm? 60.13 25.09 14.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.645 -177.671 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.75 -24.69 28.48 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 166.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 2' ' ' LYS . 3.3 tttp -118.09 165.98 13.11 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.752 -0.724 . . . . 0.0 110.21 -178.049 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.27 176.56 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.376 -166.293 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.62 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.4 m95 -148.53 -176.8 5.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 114.165 -1.379 . . . . 0.0 109.171 -178.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.932 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.4 m80 -102.98 141.83 35.11 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.473 169.309 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -60.96 -47.82 94.41 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.835 -174.549 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_exo -54.74 -27.3 51.43 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 C-N-CA 122.59 2.193 . . . . 0.0 113.609 172.624 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -83.38 -55.25 4.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.263 -167.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.536 HD22 HG21 ' A' ' 16' ' ' VAL . 3.4 tp -60.71 82.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.388 -171.126 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.75 144.9 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.393 -164.515 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.7 t -64.85 133.61 52.27 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.399 -171.281 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.34 25.42 6.28 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.439 175.143 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.476 ' HA ' ' NZ ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -130.68 -48.87 1.05 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.64 -179.597 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.8 p -109.68 -18.3 13.5 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.3 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.82 40.28 85.05 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 176.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.14 134.87 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.432 -0.384 . . . . 0.0 110.456 170.071 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.8 m -61.52 145.24 52.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.378 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.467 HD13 ' CB ' ' A' ' 42' ' ' HIS . 18.5 mt -106.9 143.31 35.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.398 -171.699 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -110.41 -169.45 1.47 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.523 -170.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.3 84.45 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 -167.476 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.87 55.52 4.12 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 167.39 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.58 12.28 4.58 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 167.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.467 ' CB ' HD13 ' A' ' 37' ' ' LEU . 12.3 p80 -108.09 -170.36 1.67 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.135 -0.533 . . . . 0.0 110.498 -178.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -177.96 157.13 1.12 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.423 161.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.492 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -136.96 153.25 50.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.07 -157.889 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 10.3 p80 -98.2 167.66 10.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.551 157.25 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.84 86.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.123 -170.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.49 -48.77 0.71 Allowed Glycine 0 CA--C 1.529 0.916 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.566 -178.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 3.6 mttt -137.33 111.53 9.17 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 121.439 0.638 . . . . 0.0 109.764 -160.225 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.492 ' HA ' ' CB ' ' A' ' 44' ' ' GLU . 15.3 Cg_endo -68.91 154.11 71.49 Favored 'Trans proline' 0 N--CA 1.484 0.959 0 C-N-CA 122.963 2.442 . . . . 0.0 113.599 167.805 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.5 OUTLIER -143.21 -167.82 2.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.827 163.777 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 87.1 m -56.56 140.24 47.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.34 -1.754 . . . . 0.0 110.453 164.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.66 -34.81 74.85 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 114.407 -1.269 . . . . 0.0 110.118 164.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.529 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 41.3 m-70 -161.8 166.2 14.95 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.275 165.454 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.529 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.8 Cg_endo -71.81 -13.75 16.23 Favored 'Cis proline' 0 N--CA 1.481 0.783 0 C-N-CA 122.681 -1.8 . . . . 0.0 113.631 -12.309 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 86.1 m -59.68 -41.18 90.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.769 -157.194 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -61.17 -36.6 80.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.374 177.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.522 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -77.28 -28.48 53.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.342 -179.92 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.17 -45.32 7.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.317 -167.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.36 -34.41 75.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.354 170.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -96.51 29.28 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.298 172.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -170.11 56.8 0.19 Allowed Glycine 0 CA--C 1.544 1.853 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 171.304 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -59.36 133.1 50.19 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 C-N-CA 122.495 2.13 . . . . 0.0 113.561 -166.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.84 28.13 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.273 165.805 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.95 137.22 2.96 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 169.572 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 69.86 138.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.378 -0.411 . . . . 0.0 110.366 168.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 155.48 93.27 0.1 OUTLIER Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 170.346 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -158.88 -80.05 0.06 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.397 -0.401 . . . . 0.0 110.317 170.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.78 -169.23 54.95 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 169.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -120.7 97.31 0.64 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -170.082 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -161.78 -39.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.369 -0.416 . . . . 0.0 110.35 169.35 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 58.99 31.62 21.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.184 173.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 61.21 -163.93 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.331 169.249 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 71.8 129.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.453 -169.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.24 170.46 9.37 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.445 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 61.02 79.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.392 169.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.335 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.55 0.558 . . . . 0.0 113.55 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -125.5 153.53 43.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.458 -168.928 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.9 t -77.36 117.59 66.37 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.438 -163.813 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.0 Cg_endo -62.11 -9.92 16.31 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 123.001 2.467 . . . . 0.0 113.344 168.133 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.98 -74.38 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.446 -177.295 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -91.94 -19.35 22.54 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.973 -167.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.4 t0 72.3 49.17 0.23 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.594 -177.229 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -106.13 -168.39 1.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.839 159.325 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 2.1 mt-10 -107.03 157.49 17.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.457 158.565 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.918 HG22 ' CD2' ' A' ' 24' ' ' HIS . 25.4 t -114.49 112.5 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.252 -159.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -73.79 159.51 32.81 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.189 -179.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -60.21 -63.08 1.43 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.85 -158.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.31 -2.98 15.1 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.661 -174.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -101.79 15.59 28.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.264 178.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.41 138.96 36.76 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.478 -163.398 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.2 m -132.72 117.71 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.523 154.178 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 46.6 m -89.79 133.05 34.91 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.209 -176.117 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.4 OUTLIER -161.51 125.91 3.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.376 -159.759 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.857 HD23 ' HG2' ' A' ' 44' ' ' GLU . 5.5 mp 59.98 19.67 8.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.764 167.137 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 124.42 -31.43 4.42 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 162.469 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -135.42 158.98 43.01 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 114.653 -0.774 . . . . 0.0 110.082 -177.188 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -79.32 178.06 8.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.236 -164.568 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 40.2 m95 -151.38 -177.48 6.09 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 113.791 -1.549 . . . . 0.0 109.216 -178.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.918 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.0 m80 -99.63 147.83 24.96 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.485 171.799 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 10.6 mmt180 -61.16 -48.77 90.97 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.712 -168.827 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB2' ' A' ' 25' ' ' ARG . 3.6 Cg_exo -64.56 -36.19 44.15 Favored 'Trans proline' 0 N--CA 1.483 0.901 0 C-N-CA 122.618 2.212 . . . . 0.0 113.613 175.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.436 ' HA ' ' NZ ' ' A' ' 29' ' ' LYS . 1.6 m -64.59 -54.06 38.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.292 -165.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.829 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -62.73 90.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.374 -166.088 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.0 OUTLIER -140.74 152.03 44.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.414 -171.355 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 7.8 t -64.27 128.66 36.77 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.293 171.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 50' ' ' TYR . 6.3 tp10 -95.7 35.25 1.39 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.199 171.859 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.47 -52.08 0.7 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.9 p -109.77 -17.57 13.64 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.17 -178.247 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.26 33.43 44.46 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.68 137.11 32.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.275 -0.462 . . . . 0.0 110.414 171.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.2 m -66.45 137.3 56.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.309 167.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.545 ' CD1' ' HB2' ' A' ' 49' ' ' PRO . 28.4 mt -100.05 149.95 22.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.394 -167.304 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -89.62 -162.42 0.88 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.63 -173.288 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.1 t -95.71 36.69 1.26 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.355 -174.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.2 57.83 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 164.486 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -134.68 12.97 4.52 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 166.37 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.829 ' NE2' HD21 ' A' ' 28' ' ' LEU . 7.3 p80 -111.66 -169.01 1.38 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 114.621 -0.789 . . . . 0.0 110.657 178.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -169.55 159.39 8.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.995 164.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.857 ' HG2' HD23 ' A' ' 19' ' ' LEU . 16.7 pt-20 -113.96 132.99 55.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.009 -161.677 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.498 ' CE1' ' CD1' ' A' ' 56' ' ' TYR . 0.7 OUTLIER -90.41 74.95 6.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.231 174.056 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 58.37 40.95 23.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.903 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.47 21.11 35.63 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.524 -1.03 . . . . 0.0 110.524 177.146 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -122.42 95.86 46.54 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-O 121.248 0.547 . . . . 0.0 109.794 168.294 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.545 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 9.3 Cg_endo -64.26 152.86 79.59 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 C-N-CA 122.577 2.185 . . . . 0.0 113.63 -167.49 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 31' ' ' GLU . 90.9 m-85 -153.94 173.12 16.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.886 173.323 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 75.8 m -56.96 133.18 54.58 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.408 163.592 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -61.25 -35.28 76.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.075 163.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 21.6 m-70 -153.02 167.32 13.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.25 163.05 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.2 Cg_endo -66.83 -21.4 7.77 Favored 'Cis proline' 0 N--CA 1.488 1.179 0 C-N-CA 122.394 -1.919 . . . . 0.0 112.807 -17.245 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.4 m -56.73 -48.79 76.98 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.282 -153.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.498 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 10.1 t80 -60.98 -49.76 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.505 -178.735 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.515 ' HA ' ' HA ' ' A' ' 62' ' ' PRO . 25.0 p -72.06 -19.15 61.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.461 -175.921 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.02 -55.3 4.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.178 -167.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 tpt -96.26 -19.91 18.94 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.219 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.472 ' HB3' ' CD1' ' A' ' 56' ' ' TYR . 0.3 OUTLIER -131.4 -167.25 1.83 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.886 -156.684 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.84 100.99 0.26 Allowed Glycine 0 CA--C 1.542 1.721 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 -168.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' A' ' 57' ' ' SER . 2.9 Cg_endo -58.02 -32.01 94.34 Favored 'Trans proline' 0 N--CA 1.484 0.918 0 C-N-CA 122.654 2.236 . . . . 0.0 113.571 -177.072 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -77.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.366 -167.406 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 134.84 -116.23 1.55 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 171.09 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 69.05 -172.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.355 -0.423 . . . . 0.0 110.373 -169.711 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.42 -110.07 0.6 Allowed Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -170.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 ttp180 -60.98 168.9 2.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.363 -169.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 153.52 -24.34 0.75 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 -170.201 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -60.99 145.44 48.28 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -170.166 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -149.94 -162.95 1.66 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.253 -169.833 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.56 167.13 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.66 -168.744 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 t -144.81 -164.26 1.88 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.355 -169.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.503 ' O ' HG22 ' A' ' 74' ' ' THR . 23.7 m-70 -100.37 138.13 37.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.364 -169.73 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.503 HG22 ' O ' ' A' ' 73' ' ' HIS . 3.2 t 60.47 35.28 20.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.909 175.02 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 70.64 143.37 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.285 170.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.597 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.371 170.162 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 113.516 0.545 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.96 134.39 44.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.419 -168.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 34.1 t -81.61 123.16 80.95 Favored Pre-proline 0 C--O 1.251 1.15 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.076 -165.304 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -63.8 -28.13 67.9 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 123.092 2.528 . . . . 0.0 113.25 169.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -70.61 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.415 -178.237 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -99.24 -26.08 14.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.716 -162.92 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.77 67.13 0.12 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.508 -167.58 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 6.9 tptp -125.51 -168.99 1.92 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.039 160.761 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -100.84 149.81 23.46 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.64 165.283 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.5 t -119.01 122.45 69.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.544 -163.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.529 ' HB3' ' HG3' ' A' ' 14' ' ' GLU . 26.9 t80 -88.36 152.09 22.16 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.387 -172.84 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HA ' ' HG3' ' A' ' 15' ' ' ARG . 90.4 m-85 -58.44 -59.51 5.24 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.468 -154.077 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.54 -13.98 59.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.653 -174.166 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -107.1 42.87 1.23 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.563 164.923 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.917 ' HG2' HG12 ' A' ' 10' ' ' VAL . 11.6 mtt85 -99.75 170.59 8.45 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.128 161.351 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.674 HG21 HD22 ' A' ' 28' ' ' LEU . 19.8 m -150.08 149.06 14.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.524 153.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -115.13 136.8 52.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.841 -167.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 t -178.57 126.89 0.11 Allowed 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.991 -165.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 59.39 19.15 7.44 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.74 -170.629 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.7 -24.46 30.77 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 166.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -105.11 158.3 16.67 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.033 -0.584 . . . . 0.0 110.159 178.009 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -91.48 176.88 6.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.259 -166.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.563 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 25.1 m95 -153.15 166.34 32.81 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 114.016 -1.447 . . . . 0.0 109.149 -176.42 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -83.04 136.93 34.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.588 168.347 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.452 ' HG3' HG13 ' A' ' 16' ' ' VAL . 6.9 mtp180 -60.88 -43.81 92.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.95 -172.404 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -59.51 -37.15 90.81 Favored 'Trans proline' 0 N--CA 1.484 0.942 0 C-N-CA 122.596 2.197 . . . . 0.0 113.638 172.515 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.3 m -69.22 -47.62 64.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.161 -167.08 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.674 HD22 HG21 ' A' ' 16' ' ' VAL . 6.0 tp -60.6 86.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.391 -166.313 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 6.5 mtmm -145.46 142.17 29.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.367 -167.241 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -61.56 129.74 42.6 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.386 172.823 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -95.15 22.55 6.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.197 171.705 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 2.7 tptt -130.46 -35.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.464 -167.582 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.8 -17.78 5.78 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.342 171.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.46 41.45 51.79 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 177.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -109.11 136.97 47.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.437 172.384 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -61.04 148.37 40.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.472 177.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 42' ' ' HIS . 93.2 mt -110.41 135.1 51.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.316 -168.012 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -93.46 -168.32 1.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.488 -167.091 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -60.66 -29.46 69.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.554 -164.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.82 62.03 0.1 Allowed Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -173.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -138.76 11.63 3.42 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.007 -0.596 . . . . 0.0 111.781 167.109 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.594 ' HB2' HD13 ' A' ' 37' ' ' LEU . 13.9 p80 -106.83 -169.45 1.55 Allowed 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.823 -0.689 . . . . 0.0 110.711 178.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.75 ' HB2' HD22 ' A' ' 52' ' ' ASN . . . -149.51 -166.91 2.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.586 164.685 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 8.4 pt-20 -133.03 135.68 45.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.405 166.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.511 ' HB2' ' CE2' ' A' ' 60' ' ' PHE . 86.3 t60 -103.14 161.77 13.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 157.637 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.432 ' H ' ' CG ' ' A' ' 45' ' ' HIS . 4.7 mt-10 -60.36 91.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.243 -159.429 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 136.91 -52.1 0.78 Allowed Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -174.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.0 144.52 35.51 Favored Pre-proline 0 C--O 1.242 0.695 0 CA-C-O 121.324 0.583 . . . . 0.0 109.939 -160.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.555 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.1 Cg_endo -69.45 162.93 39.96 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.952 2.434 . . . . 0.0 113.675 169.527 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 94.2 m-85 -156.3 -170.76 3.46 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.913 166.274 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.1 m -58.0 130.47 46.69 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.755 -1.566 . . . . 0.0 110.117 163.666 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.75 HD22 ' HB2' ' A' ' 43' ' ' ALA . 3.3 t-20 -60.64 -32.66 71.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.993 163.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 30.7 m-70 -158.65 162.77 26.02 Favored Pre-proline 0 CA--C 1.551 0.991 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.254 162.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.3 Cg_endo -73.61 -18.76 16.74 Favored 'Cis proline' 0 C--N 1.354 0.838 0 C-N-CA 122.651 -1.812 . . . . 0.0 113.829 -11.365 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.6 m -58.84 -43.08 90.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.961 -154.757 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -61.22 -60.19 4.14 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.32 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 36.7 t -65.4 -24.12 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.45 -173.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.9 -48.41 4.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.222 -166.847 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HE1' ' CZ ' ' A' ' 65' ' ' PHE . 46.8 mtp -104.0 -13.67 16.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.655 -161.334 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.511 ' CE2' ' HB2' ' A' ' 45' ' ' HIS . 4.6 m-85 -82.54 79.32 9.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.095 163.498 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.14 81.84 0.03 OUTLIER Glycine 0 CA--C 1.544 1.894 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 -167.187 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -52.46 -177.48 0.03 OUTLIER 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.47 2.113 . . . . 0.0 113.555 -166.184 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 tptm 63.92 113.83 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.371 -178.052 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 103.37 73.81 0.98 Allowed Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.393 -1.083 . . . . 0.0 110.393 169.014 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CD2' ' N ' ' A' ' 66' ' ' GLY . 64.8 t80 173.22 162.37 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.568 . . . . 0.0 110.397 175.755 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.474 ' N ' ' CD2' ' A' ' 65' ' ' PHE . . . 107.11 -109.61 3.07 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 168.391 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -61.09 146.15 48.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.463 -0.368 . . . . 0.0 110.319 -168.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 150.6 45.31 0.02 OUTLIER Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 170.191 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -119.91 -144.37 7.2 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -170.008 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.62 138.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.09 0.472 . . . . 0.0 110.399 -173.474 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -62.07 100.65 0.17 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.011 -169.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.71 -42.91 0.44 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.446 177.484 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.43 163.1 7.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.495 179.533 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.08 -60.87 0.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.4 -169.812 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 66.3 -76.31 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.356 -169.58 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt . . . . . 0 C--O 1.241 0.62 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.469 169.841 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo . . . . . 0 N--CA 1.484 0.965 0 N-CA-C 113.588 0.572 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.68 157.35 28.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.453 -169.658 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.8 t -84.08 118.07 70.32 Favored Pre-proline 0 C--O 1.25 1.106 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.166 -162.279 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.606 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.8 Cg_endo -60.03 -21.88 67.06 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.625 2.217 . . . . 0.0 113.106 170.051 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.48 -74.3 0.28 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.343 -176.647 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -93.37 -20.82 19.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.665 -165.111 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.8 t0 72.24 56.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.453 -171.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -116.45 -167.86 1.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.999 160.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.49 149.35 26.28 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.259 163.274 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.916 HG22 ' CD2' ' A' ' 24' ' ' HIS . 44.3 t -110.2 111.2 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.636 -164.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -78.81 163.73 25.1 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.318 179.831 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -60.52 -63.53 1.27 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.724 -159.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.19 -10.95 60.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.785 -174.534 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.6 44.3 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.238 170.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.55 141.44 47.16 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.607 -177.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.568 HG21 HD22 ' A' ' 28' ' ' LEU . 11.5 m -136.8 117.47 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.283 151.596 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 57.6 m -88.82 133.07 34.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.249 -175.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB2' ' NE1' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -160.7 121.37 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.435 -159.661 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HG3' ' A' ' 44' ' ' GLU . 5.5 mp 59.87 27.12 16.41 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.8 166.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.03 19.17 29.44 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 162.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -171.09 154.57 4.12 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 164.694 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.7 OUTLIER -80.15 176.68 9.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.261 -163.562 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.606 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 38.1 m95 -151.86 -176.12 5.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.353 -176.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.916 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.6 m80 -100.75 146.7 26.91 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.479 171.489 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 14.8 tpp85 -63.53 -47.31 83.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.831 -169.524 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -62.95 -31.45 77.07 Favored 'Trans proline' 0 N--CA 1.483 0.912 0 C-N-CA 122.525 2.15 . . . . 0.0 113.612 175.661 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -70.1 -43.94 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.188 -165.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.568 HD22 HG21 ' A' ' 16' ' ' VAL . 5.5 tp -69.04 77.59 0.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.27 -164.253 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 4.7 mtmt -137.44 149.65 47.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.412 -166.284 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -69.76 127.55 33.33 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.45 -178.517 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.65 18.35 20.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.712 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 55' ' ' CYS . 19.4 mmmt -101.3 -60.16 1.57 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.356 162.215 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.3 p -103.65 -35.9 8.09 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 -167.538 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 90.28 49.73 3.18 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 179.149 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.775 ' HE3' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -105.25 142.0 35.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.385 -0.408 . . . . 0.0 110.389 160.817 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.488 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 90.4 m -69.08 151.96 45.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.262 167.059 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.775 HD23 ' HE3' ' A' ' 35' ' ' LYS . 19.1 mt -116.94 156.92 26.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.26 -169.535 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -104.28 -168.21 1.46 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.627 -173.375 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.0 p -60.85 -26.38 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.547 -166.121 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.22 65.98 0.12 Allowed Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -172.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.78 16.61 2.41 Favored Glycine 0 CA--C 1.521 0.443 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 168.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.716 ' HB2' HD13 ' A' ' 37' ' ' LEU . 10.3 p80 -111.93 -169.35 1.45 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.632 -177.286 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.413 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -144.24 -164.0 1.8 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.557 165.364 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -167.05 157.27 11.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.307 163.062 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.527 ' CE1' ' HH ' ' A' ' 50' ' ' TYR . 33.6 p80 -134.08 123.34 24.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.321 162.854 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 58.32 37.68 25.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.906 -178.841 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.09 23.15 69.51 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 165.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.64 99.95 25.92 Favored Pre-proline 0 C--O 1.244 0.784 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 168.672 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 10.8 Cg_endo -67.69 168.28 18.83 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 C-N-CA 122.524 2.149 . . . . 0.0 113.614 -172.385 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.527 ' HH ' ' CE1' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -152.98 -165.04 2.08 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.075 166.252 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 84.1 m -56.85 131.12 48.53 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.141 -1.39 . . . . 0.0 110.258 161.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -33.08 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.845 160.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 27.5 m-70 -156.66 163.68 24.18 Favored Pre-proline 0 CA--C 1.552 1.02 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.23 163.591 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.471 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -73.85 -17.63 18.09 Favored 'Cis proline' 0 N--CA 1.481 0.757 0 C-N-CA 122.705 -1.79 . . . . 0.0 113.631 -12.019 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 79.3 m -59.35 -44.03 92.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.796 -155.778 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.98 -54.39 45.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.467 178.161 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -72.7 -35.24 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.323 -169.296 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.36 -47.96 58.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.36 -177.086 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.2 tpp -77.01 -34.76 57.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.442 -170.066 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -65.95 82.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.306 -171.055 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.477 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 146.71 63.66 0.01 OUTLIER Glycine 0 CA--C 1.543 1.808 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -176.151 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.477 ' HD3' ' H ' ' A' ' 61' ' ' GLY . 1.6 Cg_endo -56.61 146.31 76.65 Favored 'Trans proline' 0 N--CA 1.486 1.058 0 C-N-CA 122.396 2.064 . . . . 0.0 113.464 172.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.3 147.28 20.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.346 168.61 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.08 -59.48 3.51 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 170.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -82.3 111.74 18.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.283 -0.458 . . . . 0.0 110.182 -169.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.93 -122.44 1.87 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 170.196 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 63.37 108.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.36 -0.42 . . . . 0.0 110.299 170.158 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -95.75 -124.06 4.35 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 170.21 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 179.89 96.21 0.1 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 170.265 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.24 139.93 30.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.341 -170.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 58.56 102.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.597 168.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.9 p -82.74 -84.53 0.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.432 169.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -127.68 -43.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.368 -169.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.6 p -145.55 118.33 8.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.38 170.54 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.69 92.64 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.322 -178.361 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? . . . . . 0 C--O 1.241 0.636 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.385 -173.536 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.522 ' HD2' ' HD3' ' A' ' 21' ' ' LYS . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.076 0 N-CA-C 113.486 0.533 . . . . 0.0 113.486 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -126.22 159.61 32.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.409 -171.225 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.3 t -86.08 119.27 71.62 Favored Pre-proline 0 C--O 1.249 1.046 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.199 -167.228 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -59.4 -23.75 71.67 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.655 2.237 . . . . 0.0 113.19 169.552 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.12 -73.21 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.409 -178.53 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -97.69 -21.59 16.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.712 -161.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 73.42 67.18 0.1 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.559 -170.404 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.13 -171.19 2.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.102 159.618 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -102.22 154.94 18.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.757 166.232 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.907 HG22 ' NE2' ' A' ' 24' ' ' HIS . 59.1 t -124.19 112.03 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.828 -160.845 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.484 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.3 t80 -73.83 164.79 26.17 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.376 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -60.74 -56.93 15.32 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.798 -160.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.93 59.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.438 -1.255 . . . . 0.0 111.621 -174.311 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.646 ' O ' HG13 ' A' ' 10' ' ' VAL . 6.3 pt-20 -111.2 37.81 2.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.965 163.921 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.806 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -119.33 131.23 55.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.039 164.135 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.425 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 29.1 m -109.58 178.51 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.525 156.718 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.67 142.61 51.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.662 -176.461 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.423 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 32.6 t -177.77 136.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.376 170.545 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.08 29.12 18.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.593 -173.481 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.41 18.15 73.19 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 168.259 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HD3' ' HD2' ' A' ' 1' ' ' PRO . 9.0 mmtp -142.86 150.97 40.57 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 164.52 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 1.1 m-20 -81.3 178.33 8.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.314 -164.102 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.3 m95 -151.08 160.18 44.05 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.4 -179.347 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.907 ' NE2' HG22 ' A' ' 10' ' ' VAL . 38.5 m80 -78.19 136.21 37.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.365 166.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -60.79 -43.86 93.19 Favored Pre-proline 0 CA--C 1.545 0.763 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.786 -170.87 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.0 Cg_endo -64.07 -23.79 67.04 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.351 2.034 . . . . 0.0 113.604 175.71 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.38 -45.62 21.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.313 -173.086 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.562 HD23 ' HB2' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -73.23 91.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.206 -0.907 . . . . 0.0 110.346 -170.19 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.566 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 5.1 mtmt -152.6 141.56 21.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.385 -167.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.2 t -61.79 126.26 26.73 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.471 171.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.56 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 13.4 tp10 -97.21 20.32 11.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 170.942 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -107.36 -62.34 1.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.189 165.86 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.6 p -102.46 -19.17 15.02 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.776 -168.39 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.39 34.92 30.96 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.306 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -88.83 126.9 35.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.307 169.524 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.566 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 94.4 m -60.91 135.6 57.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.211 163.831 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 42' ' ' HIS . 81.2 mt -99.49 104.43 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.387 -163.528 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.0 t -111.1 -168.63 1.33 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.395 -169.123 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 40.5 t 58.63 -89.02 0.02 OUTLIER 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.731 162.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.96 47.32 0.07 OUTLIER Glycine 0 CA--C 1.529 0.931 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 159.35 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -116.28 20.2 12.72 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -163.175 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.652 ' HB3' HD22 ' A' ' 37' ' ' LEU . 9.2 p80 -101.4 -169.57 1.71 Allowed 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 114.916 -0.642 . . . . 0.0 110.711 177.011 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -175.41 159.51 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.14 167.803 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.446 ' HG2' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -117.62 137.45 52.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.068 -162.495 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 33.0 t60 -117.81 116.12 26.36 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 158.75 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 1.4 mt-10 60.74 -148.04 0.44 Allowed 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.439 -151.343 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.56 36.36 3.86 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 165.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 0.1 OUTLIER -109.55 88.33 6.19 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-O 121.241 0.544 . . . . 0.0 109.786 171.757 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 10.3 Cg_endo -65.89 154.2 74.93 Favored 'Trans proline' 0 N--CA 1.484 0.949 0 C-N-CA 122.493 2.128 . . . . 0.0 113.58 -176.496 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 7.8 m-85 -148.16 -165.81 2.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.795 164.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 80.5 m -59.22 135.82 57.76 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.938 161.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -60.33 -34.72 74.22 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.254 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 25.9 m-70 -156.09 172.85 5.52 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.313 164.162 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.0 Cg_endo -63.35 -18.02 5.2 Favored 'Cis proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.431 -2.32 . . . . 0.0 112.533 -22.263 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 84.8 m -57.19 -45.2 83.93 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.221 -154.644 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -60.88 -49.03 79.11 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.317 -174.328 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.413 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -68.84 -42.24 77.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.495 178.145 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.72 -50.36 30.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 -170.216 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.466 ' CG ' ' HD3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -61.04 -60.09 4.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.439 -179.741 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.502 ' CZ ' ' HB3' ' A' ' 45' ' ' HIS . 1.3 m-85 -60.73 90.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.387 -161.969 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.33 103.11 0.24 Allowed Glycine 0 CA--C 1.545 1.959 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 175.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -49.15 90.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 122.668 2.246 . . . . 0.0 113.535 -163.635 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 63' ' ' LYS . 18.9 mmtt 66.34 -78.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.552 165.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.03 86.29 0.06 OUTLIER Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -165.491 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 61.1 -169.31 0.17 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.122 0.487 . . . . 0.0 110.334 167.548 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.81 58.8 0.35 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.36 -1.096 . . . . 0.0 110.36 169.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.39 83.99 2.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.971 -0.615 . . . . 0.0 110.432 -179.022 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.33 132.85 10.58 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -170.057 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -68.36 -62.7 3.98 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 169.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.21 79.99 0.23 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.381 -0.409 . . . . 0.0 110.253 169.421 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -117.31 -18.16 9.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.075 -168.831 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.7 t -140.07 93.49 2.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.331 169.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 67.3 -80.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.41 169.561 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.61 HG22 ' H ' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -124.5 -178.88 4.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.472 -169.825 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.61 ' H ' HG22 ' A' ' 74' ' ' THR . 24.3 m-85 -85.82 168.56 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.383 -170.081 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? . . . . . 0 C--O 1.24 0.58 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.296 169.994 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.72 150.77 51.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.391 -168.958 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 26.4 t -84.47 117.6 69.11 Favored Pre-proline 0 C--O 1.25 1.127 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.253 -164.201 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.617 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 1.3 Cg_endo -61.16 -20.08 66.33 Favored 'Trans proline' 0 N--CA 1.489 1.217 0 C-N-CA 122.784 2.322 . . . . 0.0 113.254 170.056 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.501 ' HG3' ' HB3' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -78.97 -73.48 0.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.464 -177.543 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -94.61 -21.98 18.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.527 -164.487 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 72.55 64.56 0.12 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.501 -169.061 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -125.38 -168.58 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.083 161.465 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.66 151.63 23.46 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.592 161.922 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.921 HG22 ' CD2' ' A' ' 24' ' ' HIS . 33.9 t -112.21 112.57 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.494 -161.296 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.78 151.43 35.98 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.251 179.381 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -60.22 -49.38 77.86 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.007 -158.398 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.3 -0.78 33.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.472 -167.487 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -104.24 4.39 33.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 174.378 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.57 152.88 33.77 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.312 -160.811 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 28' ' ' LEU . 21.7 m -150.29 136.8 12.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.754 159.116 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.9 m -113.19 135.11 54.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.505 -165.603 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.41 ' OG ' HD22 ' A' ' 19' ' ' LEU . 22.4 t -178.01 136.01 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.536 -165.692 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.0 mm? 60.14 21.64 10.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.593 -174.42 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 16.89 79.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 169.407 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.43 158.84 43.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 163.15 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.06 176.84 7.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.249 -164.816 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.617 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 30.9 m95 -150.13 179.94 7.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 113.983 -1.462 . . . . 0.0 109.227 -179.275 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.921 ' CD2' HG22 ' A' ' 10' ' ' VAL . 41.8 m80 -96.03 150.88 19.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.425 166.559 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.583 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -61.48 -58.91 15.42 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.875 178.336 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 13.3 Cg_endo -54.28 -22.79 27.62 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 122.188 1.925 . . . . 0.0 113.619 -177.426 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.501 ' HB3' ' HG3' ' A' ' 5' ' ' LYS . 8.0 m -81.45 -53.97 5.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.382 -172.247 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.85 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.3 tp -63.71 93.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.482 -161.843 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -142.49 146.67 34.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.408 -176.79 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 5.4 t -60.09 126.51 27.82 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.541 174.287 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.499 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 1.2 tt0 -94.75 27.7 2.97 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.104 172.116 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -124.19 -55.8 1.66 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.468 173.668 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.9 p -107.4 -21.8 12.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.832 -172.546 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.96 51.42 23.97 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -171.348 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 tptm -98.05 123.47 42.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.14 163.566 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.4 m -61.43 133.46 55.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.118 170.096 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.455 HD13 ' HB2' ' A' ' 42' ' ' HIS . 94.8 mt -98.2 138.03 36.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.426 -161.733 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 40' ' ' GLY . 68.7 m -60.42 150.28 31.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.268 165.406 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.0 t -64.84 65.9 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.63 162.204 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 38' ' ' THR . . . 138.69 150.04 5.54 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.527 -164.536 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 77.82 14.74 82.05 Favored Glycine 0 C--N 1.344 0.986 0 C-N-CA 119.934 -1.127 . . . . 0.0 111.37 171.926 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.85 ' CE1' HD11 ' A' ' 28' ' ' LEU . 8.3 p80 -120.11 -167.03 1.37 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 113.993 -1.104 . . . . 0.0 110.809 175.141 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -156.66 -165.63 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.899 -173.442 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -171.4 172.76 5.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.99 164.206 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.474 ' CD2' ' CE1' ' A' ' 50' ' ' TYR . 34.4 p80 -130.83 104.73 7.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.353 162.406 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 58.45 42.8 20.56 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.884 177.023 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . 110.67 -18.91 26.65 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 166.948 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mttt -98.73 101.11 11.01 Favored Pre-proline 0 C--O 1.243 0.752 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 -170.934 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' GLU . 10.6 Cg_endo -65.82 157.99 56.08 Favored 'Trans proline' 0 N--CA 1.487 1.109 0 C-N-CA 122.472 2.115 . . . . 0.0 113.533 -171.059 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 62.8 m-85 -152.45 -176.75 5.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.052 169.964 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 71.3 m -57.42 134.2 55.83 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.029 158.908 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HA ' ' A' ' 42' ' ' HIS . 5.8 t30 -69.47 -29.5 67.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.761 160.699 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 13.9 m-70 -153.59 161.03 30.21 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.153 164.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 10.0 Cg_endo -73.62 -16.79 18.45 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 122.685 -1.798 . . . . 0.0 113.675 -12.516 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 72.4 m -59.4 -53.45 58.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.752 -156.161 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -61.03 -48.1 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.5 178.762 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.445 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 27.1 p -65.53 -21.21 66.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.33 -176.762 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . -84.18 -52.41 6.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.16 -168.661 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -106.82 -33.29 7.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.363 -174.89 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -90.93 -170.53 2.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.299 167.205 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -119.3 152.33 17.26 Favored Glycine 0 CA--C 1.543 1.818 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -173.252 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -59.04 140.39 95.06 Favored 'Trans proline' 0 N--CA 1.483 0.911 0 C-N-CA 122.363 2.042 . . . . 0.0 113.628 -178.55 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.86 -18.92 19.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.417 170.141 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.86 178.49 3.42 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 -169.408 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -67.16 -172.95 0.23 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.474 -169.509 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 175.57 82.47 0.06 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 170.071 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -173.01 174.2 3.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.415 170.152 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -172.27 166.02 38.74 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 -170.229 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.99 -133.58 1.96 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 170.399 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.2 115.55 30.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.365 -0.418 . . . . 0.0 110.305 -169.907 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.4 138.99 57.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.009 -168.834 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.89 162.22 33.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.394 -169.379 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.489 ' O ' HG22 ' A' ' 74' ' ' THR . 5.8 m80 -64.6 -23.98 67.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.38 169.943 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 73' ' ' HIS . 3.2 t 60.45 39.19 18.7 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.908 175.124 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 70.57 -76.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.233 -174.458 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 pttt . . . . . 0 C--O 1.24 0.566 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.432 -170.046 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.587 ' H2 ' ' HD3' ' A' ' 2' ' ' LYS . 5.4 Cg_exo . . . . . 0 N--CA 1.485 0.991 0 N-CA-C 113.503 0.54 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.587 ' HD3' ' H2 ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -135.09 132.26 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.414 -175.191 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 33.9 t -80.68 121.69 81.44 Favored Pre-proline 0 C--O 1.251 1.134 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.029 -162.66 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -63.43 -27.13 70.63 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 C-N-CA 122.957 2.438 . . . . 0.0 113.311 174.256 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -73.3 0.25 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.288 -179.178 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.5 p -91.95 -22.86 19.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.748 -160.998 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.6 t0 72.39 67.74 0.13 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.482 -169.809 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HB2' ' HE1' ' A' ' 24' ' ' HIS . 0.0 OUTLIER -127.17 -168.77 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.156 162.155 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 152.93 22.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.601 162.254 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 74.9 t -122.04 110.46 27.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.945 -163.765 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -73.32 162.54 29.23 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.423 -178.666 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.486 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.7 OUTLIER -60.97 -55.73 29.52 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.822 -161.594 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.48 -9.25 59.57 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.579 -174.195 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.536 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . 2.2 mt-10 -112.49 35.79 3.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.129 163.38 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.799 ' HB3' HG12 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -119.08 136.39 54.17 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.097 165.253 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.696 HG21 HD22 ' A' ' 28' ' ' LEU . 16.1 m -123.76 135.56 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.514 156.42 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 3.4 m -103.57 138.43 40.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.485 -170.685 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.491 ' C ' HD22 ' A' ' 19' ' ' LEU . 5.1 t -170.39 131.39 0.94 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.383 -166.315 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.643 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.99 17.58 6.79 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.571 -173.355 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.81 -25.37 22.82 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 165.35 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 148.52 43.62 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.773 -0.714 . . . . 0.0 110.232 -178.27 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -81.78 177.6 8.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.17 -164.071 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 23.9 m95 -151.09 163.81 37.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.048 -1.433 . . . . 0.0 109.377 -177.147 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.2 m80 -84.6 140.11 31.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.593 170.426 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' CG ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.26 -44.21 92.55 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.961 -167.524 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD3' ' CG ' ' A' ' 25' ' ' ARG . 9.1 Cg_exo -51.96 -47.73 25.11 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 122.752 2.301 . . . . 0.0 113.424 166.446 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 m -63.95 -46.01 86.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.467 -165.717 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.86 HD21 ' CE1' ' A' ' 42' ' ' HIS . 1.6 tp -62.4 92.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -169.993 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.586 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 9.7 mtpm? -143.3 140.08 30.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.392 -170.111 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 10.7 t -60.23 129.11 40.07 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.448 171.363 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -98.81 39.78 1.24 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 114.095 -1.412 . . . . 0.0 110.242 172.458 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -143.23 -43.8 0.29 Allowed 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.362 -175.674 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.2 p -115.25 -19.05 10.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.006 173.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.84 41.78 54.9 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 179.41 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.402 ' CE ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.86 133.56 44.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.315 169.667 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.2 m -60.74 136.27 58.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.299 168.461 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.865 HD13 ' HB2' ' A' ' 42' ' ' HIS . 96.5 mt -97.9 132.62 43.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.308 -164.82 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 t -106.03 -168.67 1.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.524 -166.246 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.6 t -60.91 89.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.433 -165.067 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.57 55.45 20.34 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 163.825 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.5 21.55 2.73 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 164.537 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.865 ' HB2' HD13 ' A' ' 37' ' ' LEU . 9.7 p80 -115.17 -166.9 1.16 Allowed 'General case' 0 CA--C 1.524 -0.057 0 CA-C-N 114.92 -0.64 . . . . 0.0 110.581 -176.747 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -161.4 -164.46 1.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.706 -169.452 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.4 148.89 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.177 163.065 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.503 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 9.1 p80 -91.13 165.35 13.54 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.458 157.051 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.68 87.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.1 -167.832 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 145.16 -61.5 0.49 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.581 -1.007 . . . . 0.0 110.581 -169.149 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -135.33 142.34 41.13 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-O 121.693 0.758 . . . . 0.0 109.78 -162.108 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.586 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 13.6 Cg_endo -72.42 158.31 51.56 Favored 'Trans proline' 0 N--CA 1.483 0.894 0 C-N-CA 122.865 2.377 . . . . 0.0 113.757 173.697 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 34.2 m-85 -147.0 178.01 8.69 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.946 168.74 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.7 m -56.44 140.44 45.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.474 163.25 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -60.66 -34.26 74.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.111 165.202 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.541 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.8 m-70 -162.63 166.42 13.73 Favored Pre-proline 0 CA--C 1.552 1.019 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.331 165.556 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.1 Cg_endo -71.91 -13.15 16.54 Favored 'Cis proline' 0 C--N 1.353 0.774 0 C-N-CA 122.745 -1.773 . . . . 0.0 113.569 -12.7 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.504 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 83.8 m -59.82 -41.26 90.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.68 -157.286 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.547 ' CE2' ' HB3' ' A' ' 62' ' ' PRO . 10.9 t80 -61.06 -38.2 85.36 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.367 176.856 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.581 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 17.1 t -75.77 -18.19 59.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.464 176.503 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.32 -54.14 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.143 -168.79 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.8 mmm -103.18 -25.16 13.47 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.338 -175.227 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.487 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 10.9 m-85 -117.05 -170.29 1.81 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.258 167.829 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -138.0 102.43 0.37 Allowed Glycine 0 CA--C 1.544 1.844 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.35 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.581 ' HD3' ' HA ' ' A' ' 57' ' ' SER . 1.6 Cg_endo -54.65 -60.33 0.62 Allowed 'Trans proline' 0 N--CA 1.487 1.089 0 C-N-CA 122.451 2.101 . . . . 0.0 113.502 -169.851 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 pttp 58.41 19.71 6.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.596 174.454 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.92 -121.44 4.34 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -171.01 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -76.6 -178.38 4.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.433 -0.384 . . . . 0.0 110.357 -168.85 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.37 -167.15 28.55 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 170.42 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 65.47 116.48 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.284 -0.458 . . . . 0.0 110.432 169.672 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.78 157.43 7.92 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 169.214 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.4 171.51 12.97 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 169.99 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.93 114.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.241 169.592 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 58.56 110.51 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.631 167.965 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.0 p -104.22 -164.26 1.04 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.36 168.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.0 179.93 4.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.342 170.063 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.7 p -144.69 25.04 1.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.452 -170.036 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -89.04 -64.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.332 -176.604 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.8 tptt . . . . . 0 C--O 1.24 0.601 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.372 170.083 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.461 ' CD ' ' HE2' ' A' ' 21' ' ' LYS . 5.6 Cg_endo . . . . . 0 N--CA 1.486 1.03 0 N-CA-C 113.562 0.562 . . . . 0.0 113.562 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 28.9 mttp -133.53 156.63 47.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.455 170.591 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 30.3 t -86.1 123.28 72.0 Favored Pre-proline 0 C--O 1.25 1.128 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.167 -164.355 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.619 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -62.65 -30.31 78.68 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 122.808 2.338 . . . . 0.0 113.164 169.424 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -69.21 0.37 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.495 -175.313 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -98.33 -22.58 16.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 -165.178 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 72.9 59.68 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.52 -171.543 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.458 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -124.59 -172.06 2.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.142 159.2 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER -100.76 153.1 19.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.7 168.803 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.917 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -118.12 113.46 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.74 -164.261 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.545 ' CZ ' ' HG3' ' A' ' 14' ' ' GLU . 34.9 p90 -82.17 163.88 21.64 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.359 -178.095 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.541 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 m-85 -58.12 -59.5 5.2 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.26 -153.288 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.35 -11.24 59.81 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.698 -174.615 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.677 ' O ' HG13 ' A' ' 10' ' ' VAL . 14.4 mt-10 -108.2 46.2 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.807 164.32 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' HD2' ' HA ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -118.59 141.34 48.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.699 161.91 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG21 HD22 ' A' ' 28' ' ' LEU . 17.8 m -136.81 131.52 47.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.712 157.695 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 34.3 m -97.98 144.19 27.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.481 -164.531 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.658 ' OG ' ' HE1' ' A' ' 42' ' ' HIS . 23.8 t -171.39 130.11 0.72 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.43 -171.035 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.17 15.08 4.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.698 -168.577 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 100.19 -24.58 31.57 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 170.661 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.461 ' HE2' ' CD ' ' A' ' 1' ' ' PRO . 0.0 OUTLIER -110.98 140.31 45.6 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 114.806 -0.697 . . . . 0.0 110.091 -178.897 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 5.6 m-20 -77.77 177.92 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.212 -161.299 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.619 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 31.7 m95 -150.59 171.15 17.56 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 113.82 -1.536 . . . . 0.0 109.279 179.739 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.917 ' CD2' HG22 ' A' ' 10' ' ' VAL . 44.4 m80 -88.75 149.14 23.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.506 174.925 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.574 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 4.6 tpp180 -61.32 -45.73 95.01 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.876 -170.975 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -64.24 -34.89 54.54 Favored 'Trans proline' 0 N--CA 1.484 0.956 0 C-N-CA 122.582 2.188 . . . . 0.0 113.601 174.378 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.31 -47.4 61.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.216 -164.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.867 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.5 tp -61.72 83.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.296 -168.444 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -144.88 152.0 39.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.442 -165.567 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.0 t -70.05 138.67 52.3 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.459 -177.777 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG3' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -89.65 -23.31 21.93 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.735 174.555 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.553 ' HD2' ' HE3' ' A' ' 59' ' ' MET . 2.2 tptp -71.08 -64.63 0.87 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.957 172.81 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.1 p -108.47 -19.79 13.33 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.965 -159.493 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.73 42.82 53.1 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 177.627 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -100.19 136.52 39.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.346 166.3 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 m -60.69 146.19 46.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.323 170.891 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 96.5 mt -110.38 153.05 25.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.288 -163.231 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 39' ' ' SER . 14.5 m -105.83 170.29 7.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.452 -163.569 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.581 ' H ' HG22 ' A' ' 38' ' ' THR . 4.5 t -61.64 -17.67 56.31 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.459 -168.344 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.91 57.19 0.14 Allowed Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.97 11.61 3.63 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 114.917 -0.642 . . . . 0.0 111.753 166.889 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.867 ' NE2' HD21 ' A' ' 28' ' ' LEU . 27.6 p80 -111.11 -169.8 1.52 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.144 0.497 . . . . 0.0 111.007 -177.662 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -154.24 -165.14 2.01 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.871 167.949 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.508 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -171.84 158.41 4.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.126 171.516 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.422 ' N ' ' HG2' ' A' ' 44' ' ' GLU . 10.1 p80 -123.2 172.76 8.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.957 157.947 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -61.42 91.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.192 -163.906 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.65 -65.77 0.34 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -169.181 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.499 ' HD2' ' CE2' ' A' ' 50' ' ' TYR . 2.6 pttp -152.89 138.98 12.07 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-O 121.91 0.862 . . . . 0.0 109.961 -163.501 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.594 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 20.5 Cg_endo -69.28 170.01 16.98 Favored 'Trans proline' 0 N--CA 1.485 1.026 0 C-N-CA 122.934 2.422 . . . . 0.0 113.572 170.127 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -153.64 -164.99 2.02 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.908 162.859 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 89.0 m -57.19 136.82 56.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.259 159.973 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -61.27 -31.93 71.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.938 163.606 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.536 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 33.9 m-70 -161.51 165.99 15.62 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.305 165.466 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -72.03 -14.25 16.56 Favored 'Cis proline' 0 N--CA 1.482 0.8 0 C-N-CA 122.557 -1.851 . . . . 0.0 113.582 -13.934 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 81.0 m -59.81 -42.3 93.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.682 -157.11 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 60' ' ' PHE . 11.4 t80 -61.0 -39.25 88.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.53 176.083 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 15.9 t -84.54 -12.42 54.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.291 -173.901 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.31 -47.56 19.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.32 175.906 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.553 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 1.6 mpp? -81.71 -41.25 21.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.457 -170.112 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 56' ' ' TYR . 0.8 OUTLIER -61.26 90.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.327 -165.334 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -112.15 -153.2 11.99 Favored Glycine 0 CA--C 1.543 1.843 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 169.829 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -62.61 -12.32 27.72 Favored 'Trans proline' 0 N--CA 1.483 0.904 0 C-N-CA 122.463 2.109 . . . . 0.0 113.554 178.078 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.467 ' HG2' ' N ' ' A' ' 64' ' ' GLY . 2.4 ttmm -61.04 148.4 40.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.414 -168.103 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.467 ' N ' ' HG2' ' A' ' 63' ' ' LYS . . . -148.4 -132.31 2.15 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 169.66 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 10.9 t80 178.79 -80.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.348 169.042 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.93 -153.33 17.4 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.277 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.454 ' HB3' ' NH1' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -61.14 -77.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.366 -169.229 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 167.89 -127.84 1.62 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -169.712 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.49 -158.3 18.21 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 110.431 -1.068 . . . . 0.0 110.431 170.547 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -133.12 -166.61 1.79 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.296 -169.763 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.92 -81.15 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.018 -168.791 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.5 p -177.61 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.465 169.113 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -173.44 29.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.414 -169.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.7 m -94.26 138.75 31.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.436 -177.167 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 66.8 -76.13 0.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.321 -170.124 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.8 mttp . . . . . 0 C--O 1.24 0.587 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.387 -170.078 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.407 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 113.489 0.534 . . . . 0.0 113.489 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -134.64 141.02 46.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.388 -168.734 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.9 t -82.25 117.02 66.92 Favored Pre-proline 0 C--O 1.249 1.051 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.164 -163.917 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.572 ' HD2' ' CE3' ' A' ' 23' ' ' TRP . 1.4 Cg_endo -60.83 -21.92 72.06 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.727 2.285 . . . . 0.0 113.216 170.049 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? -76.42 -71.1 0.41 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.482 -175.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.64 -22.72 16.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.582 -164.991 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t70 72.47 55.49 0.15 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.503 -171.38 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.479 ' HA ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -117.5 -169.25 1.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.948 159.771 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -101.94 148.43 25.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.65 167.096 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.7 t -109.7 111.09 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 114.57 -1.195 . . . . 0.0 109.651 -167.053 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 34.7 t80 -74.79 159.03 32.47 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 114.648 -1.16 . . . . 0.0 110.306 178.01 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.463 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 6.7 m-85 -60.58 -62.38 1.9 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.75 -160.118 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.43 -1.72 11.63 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.72 -173.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -102.27 14.06 32.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.379 178.625 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -96.6 151.41 19.63 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.33 -161.496 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.522 HG21 HD22 ' A' ' 28' ' ' LEU . 16.0 m -143.9 145.02 22.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.601 156.19 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.1 m -115.71 136.26 53.23 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.715 -166.965 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 t -178.43 128.69 0.12 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.195 -169.316 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.5 mm? 60.12 34.97 21.23 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.605 -172.479 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.46 18.13 60.68 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 168.119 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -141.4 155.3 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 165.284 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 1.1 m-20 -90.95 176.58 6.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.403 -165.822 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.583 ' CZ3' ' HD3' ' A' ' 49' ' ' PRO . 26.2 m95 -149.8 -177.88 6.14 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.24 -177.079 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.9 m80 -99.2 145.97 26.66 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.553 168.928 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.1 mtp180 -61.22 -48.65 91.05 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.726 -168.899 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -64.0 -34.8 57.68 Favored 'Trans proline' 0 N--CA 1.483 0.87 0 C-N-CA 122.492 2.128 . . . . 0.0 113.647 177.049 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -64.01 -45.39 89.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.338 -166.131 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.638 HD21 ' NE2' ' A' ' 42' ' ' HIS . 9.6 tp -60.41 93.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.316 -162.173 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 36' ' ' THR . 2.2 mttt -141.02 153.58 45.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.331 -164.268 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.4 t -73.35 126.4 30.05 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.403 173.27 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 19.3 mt-10 -96.09 33.46 1.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.046 168.509 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.423 ' HA ' ' CE ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -128.05 -52.8 1.31 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.077 175.619 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.21 -18.81 13.21 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.018 -177.462 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.12 36.42 40.63 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.384 -1.086 . . . . 0.0 110.384 175.762 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -100.39 137.0 39.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.476 170.38 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 23.3 m -66.96 147.96 52.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.433 170.315 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.766 HD13 ' CB ' ' A' ' 42' ' ' HIS . 6.9 mt -113.08 154.25 26.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.269 -169.939 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.2 m -154.28 158.24 39.9 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.128 -160.597 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m 60.59 11.96 3.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.122 171.519 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 59.19 54.45 37.81 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.201 -1.159 . . . . 0.0 110.201 -159.406 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.82 6.61 83.5 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 114.634 -0.783 . . . . 0.0 111.959 177.675 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.766 ' CB ' HD13 ' A' ' 37' ' ' LEU . 5.6 p80 -107.07 -172.18 2.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.38 -166.195 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -142.88 -163.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.813 163.897 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 5.8 tt0 -147.86 133.85 19.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.258 176.497 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.487 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 86.4 t60 -135.14 125.28 26.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 162.936 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.27 -150.19 0.42 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.646 -152.753 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -96.0 32.46 6.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 166.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -117.84 99.16 52.1 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-O 121.702 0.763 . . . . 0.0 109.799 170.724 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.0 Cg_endo -58.81 165.34 8.36 Favored 'Trans proline' 0 N--CA 1.486 1.04 0 C-N-CA 122.161 1.907 . . . . 0.0 113.649 173.302 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.517 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 81.1 m-85 -153.73 -165.46 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.072 171.311 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 72.4 m -57.45 133.21 55.0 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.351 162.543 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -60.7 -31.01 70.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.926 161.469 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.446 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 25.1 m-70 -159.4 162.24 25.94 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.115 163.858 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -74.28 -17.42 18.95 Favored 'Cis proline' 0 N--CA 1.482 0.805 0 C-N-CA 122.716 -1.785 . . . . 0.0 113.552 -14.093 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 75.6 m -59.19 -37.05 76.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.796 -155.311 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -62.49 -60.63 3.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.384 172.079 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.446 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 1.6 m -71.74 -17.19 62.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.414 -166.2 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.98 -51.58 13.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.334 171.651 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.6 ttt -81.79 -43.32 18.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.382 -169.577 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.487 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 9.8 m-85 -118.09 113.83 22.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.35 171.033 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -61.0 141.48 48.26 Favored Glycine 0 CA--C 1.542 1.774 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 -168.408 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.418 ' HG3' ' OG ' ' A' ' 57' ' ' SER . 2.8 Cg_exo -62.43 98.72 0.19 Allowed 'Trans proline' 0 N--CA 1.484 0.965 0 C-N-CA 122.605 2.203 . . . . 0.0 113.494 -173.651 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -117.31 -17.69 10.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.553 170.158 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.34 -170.77 33.06 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 170.37 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 65' ' ' PHE . 1.5 p90 -137.6 -173.95 3.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.407 -0.397 . . . . 0.0 110.33 169.991 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.55 159.76 8.69 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 -170.143 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 0.3 OUTLIER 64.48 80.45 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.347 -0.426 . . . . 0.0 110.494 -169.985 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -86.1 104.35 2.87 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 177.75 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.81 -163.71 35.73 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -170.124 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.69 93.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.368 -0.416 . . . . 0.0 110.236 169.919 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.81 -13.52 24.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.092 168.448 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.41 38.19 5.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.373 178.202 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m170 -61.38 98.58 0.09 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.447 177.932 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.41 24.62 12.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.401 170.304 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -94.82 149.41 21.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.356 169.933 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.503 ' HD2' ' H ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.586 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.415 -170.068 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.486 1.064 0 N-CA-C 113.554 0.559 . . . . 0.0 113.554 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.515 ' HG2' ' NZ ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -144.36 144.31 31.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.375 169.635 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 31.7 t -87.79 118.89 70.28 Favored Pre-proline 0 C--O 1.251 1.136 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.135 -164.56 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.582 ' HG2' ' CH2' ' A' ' 23' ' ' TRP . 1.9 Cg_endo -60.97 -27.15 84.35 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.712 2.275 . . . . 0.0 113.211 169.108 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -69.78 0.36 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.459 -173.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -96.59 -22.07 17.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.621 -166.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 72.05 53.73 0.19 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.45 -171.238 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 -167.91 1.25 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.001 160.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.48 149.09 26.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.269 162.803 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 52.0 t -109.62 111.15 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.667 -166.502 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.485 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.6 t80 -78.84 161.76 26.54 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.282 178.117 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.68 -62.64 1.73 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.966 -157.723 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.4 -10.83 60.16 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.779 -173.681 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 8.8 pt-20 -103.04 43.09 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.189 171.15 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -111.84 147.31 36.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.548 -177.45 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 15.5 m -140.43 143.15 29.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.459 154.188 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.9 m -115.61 133.82 55.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.616 -166.617 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.475 ' OG ' HD22 ' A' ' 19' ' ' LEU . 17.1 t -178.3 136.68 0.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.333 -171.4 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 59.97 29.43 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.65 -172.992 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.23 17.33 70.06 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 167.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' NZ ' ' HG2' ' A' ' 2' ' ' LYS . 1.2 tttm -143.64 160.13 41.22 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 164.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.02 177.34 6.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.306 -165.686 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.582 ' CH2' ' HG2' ' A' ' 4' ' ' PRO . 27.6 m95 -151.94 -174.94 5.03 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.116 -178.84 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.8 m80 -101.4 146.99 26.87 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.543 169.546 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 51.1 ttp180 -60.98 -47.14 96.35 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.727 -168.75 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.1 Cg_endo -63.43 -35.36 61.47 Favored 'Trans proline' 0 N--CA 1.484 0.936 0 C-N-CA 122.55 2.166 . . . . 0.0 113.576 175.483 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -67.1 -50.81 60.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.328 -163.236 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.429 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.3 tp -60.37 89.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.339 -163.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.3 ttmm -147.57 141.96 26.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.321 -164.95 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.5 t -60.83 119.71 8.73 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.283 165.627 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -96.91 27.2 4.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.962 168.02 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.73 -55.71 2.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.092 169.165 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.3 p -106.96 -24.52 11.98 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.652 -174.351 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.79 45.3 7.3 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -177.436 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.24 124.87 46.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.304 168.137 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 m -61.0 139.48 58.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.269 168.109 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 75.0 mt -103.39 127.03 50.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.273 -165.371 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -69.57 -170.21 0.28 Allowed 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.565 169.603 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -105.14 18.15 22.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.6 -168.474 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.696 ' H ' HG23 ' A' ' 38' ' ' THR . . . -178.62 58.71 0.09 OUTLIER Glycine 0 CA--C 1.531 1.048 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 162.334 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.25 10.98 1.56 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-N 114.32 -0.94 . . . . 0.0 111.88 168.446 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . 14.6 p80 -113.4 -169.09 1.43 Allowed 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.415 -0.392 . . . . 0.0 110.868 -175.913 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 49' ' ' PRO . . . -154.08 -164.17 1.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.909 168.201 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.526 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 2.3 pp20? -164.08 139.52 6.11 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.085 170.638 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CG ' ' CE1' ' A' ' 60' ' ' PHE . 57.0 t60 -95.3 161.99 13.86 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.3 159.951 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 45' ' ' HIS . 28.6 mm-40 -61.44 88.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.049 -166.364 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.18 -66.0 0.35 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.304 -1.119 . . . . 0.0 110.304 -167.059 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.14 141.91 19.09 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 121.422 0.63 . . . . 0.0 109.82 -163.445 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.54 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 11.7 Cg_endo -68.44 160.05 50.82 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.967 2.445 . . . . 0.0 113.734 169.552 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 60.8 m-85 -147.63 -163.35 1.75 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.568 164.426 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 88.2 m -56.94 138.36 54.13 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.265 159.078 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -60.73 -35.84 77.37 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.988 164.113 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.477 ' ND1' ' HB2' ' A' ' 57' ' ' SER . 27.4 m-70 -157.85 165.14 19.3 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.227 164.423 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.7 Cg_endo -73.07 -15.36 18.1 Favored 'Cis proline' 0 C--N 1.354 0.868 0 C-N-CA 122.512 -1.87 . . . . 0.0 113.595 -14.192 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 64.8 m -59.61 -39.42 84.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.619 -156.636 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -61.15 -56.99 14.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.351 171.919 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.477 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -65.66 -26.52 67.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.399 -169.418 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.43 -42.32 11.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.321 -169.896 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -50.6 12.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.32 -175.302 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CE1' ' CG ' ' A' ' 45' ' ' HIS . 15.9 m-85 -94.01 90.36 6.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.388 -167.531 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -132.78 -99.27 0.71 Allowed Glycine 0 CA--C 1.545 1.922 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 170.366 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -57.78 172.13 1.25 Allowed 'Trans proline' 0 N--CA 1.488 1.147 0 C-N-CA 122.4 2.067 . . . . 0.0 113.368 167.075 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.1 tptt 179.89 -77.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.352 169.539 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.78 122.31 4.63 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 -168.17 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.3 t80 71.68 146.51 0.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.287 172.246 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 171.92 -72.33 0.1 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 170.383 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -143.44 141.67 30.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.377 -0.412 . . . . 0.0 110.355 169.96 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -157.47 153.47 24.69 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -178.386 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.37 165.54 13.73 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -178.329 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -122.5 29.76 6.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.256 169.885 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.55 165.64 12.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.1 168.841 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.8 t -106.9 -63.18 1.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.384 -169.197 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -159.28 -59.7 0.07 Allowed 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.414 177.851 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.5 p -64.95 156.11 32.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.494 169.998 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -118.4 20.24 13.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.36 -169.977 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.368 170.067 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.443 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 12.1 Cg_endo . . . . . 0 N--CA 1.486 1.044 0 N-CA-C 113.617 0.583 . . . . 0.0 113.617 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.442 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -143.9 152.83 41.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.461 -167.063 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 29.0 t -89.99 118.01 68.55 Favored Pre-proline 0 C--O 1.249 1.043 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.177 -165.657 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.604 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.2 Cg_endo -57.89 -26.82 76.05 Favored 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.61 2.207 . . . . 0.0 113.175 168.933 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -74.45 -73.41 0.23 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.417 -174.885 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.4 p -93.87 -21.8 19.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 -165.683 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 t0 72.59 58.63 0.13 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.526 -172.601 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' NZ ' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -119.74 -168.96 1.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.027 159.452 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 3.7 mt-10 -102.71 154.03 19.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.696 162.851 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 37.1 t -113.5 114.06 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.452 -162.85 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.62 154.79 41.51 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.365 177.125 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.65 -62.24 2.0 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.847 -159.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.44 -1.22 10.12 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.648 -173.399 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -102.57 14.09 32.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.466 178.315 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 153.27 17.97 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 -160.815 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.804 HG21 HD22 ' A' ' 28' ' ' LEU . 15.1 m -145.11 151.15 15.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.699 155.703 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -115.41 136.23 53.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.724 -168.726 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.504 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 23.1 t -177.84 135.75 0.18 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.279 -177.923 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.3 mm? 60.04 28.41 17.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -169.844 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.27 18.21 64.86 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 170.22 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.558 ' HD3' ' HG3' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -138.05 153.85 49.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 164.893 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -87.87 176.35 7.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.412 -165.973 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.604 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 29.4 m95 -147.52 -177.99 6.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.134 -176.907 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.3 m80 -100.96 141.36 33.96 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 113.965 -1.471 . . . . 0.0 110.526 167.691 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.35 84.97 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.827 -168.251 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.562 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 10.2 Cg_endo -58.5 -35.65 98.4 Favored 'Trans proline' 0 N--CA 1.483 0.905 0 C-N-CA 122.608 2.205 . . . . 0.0 113.538 174.78 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.91 -43.5 98.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.114 -168.832 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.985 HD11 ' CE1' ' A' ' 42' ' ' HIS . 11.9 tp -63.29 86.62 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.455 -160.442 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -131.51 148.74 52.66 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.247 -167.982 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.6 t -75.22 129.41 37.42 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.345 172.322 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' CB ' ' CE2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -98.05 41.87 1.11 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.163 166.581 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.718 ' HD3' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -143.55 -40.79 0.3 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.466 -176.949 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.06 -12.61 9.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.332 173.579 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.9 42.45 99.65 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -124.24 136.89 54.49 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 164.332 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 29' ' ' LYS . 2.7 t -61.37 -170.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.242 -169.142 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.655 HD13 ' CB ' ' A' ' 42' ' ' HIS . 12.0 mt -143.1 150.96 40.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.478 -163.671 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -83.05 -171.99 3.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.294 -164.019 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 38' ' ' THR . 97.6 p -64.39 77.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.323 166.12 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.48 53.96 9.42 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 178.642 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -119.59 12.93 10.96 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.469 -0.653 . . . . 0.0 111.469 165.791 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.985 ' CE1' HD11 ' A' ' 28' ' ' LEU . 9.8 p80 -102.56 -168.79 1.57 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.579 -0.81 . . . . 0.0 110.528 175.933 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.18 158.62 14.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.889 161.304 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.459 ' HB2' ' HH2' ' A' ' 23' ' ' TRP . 2.2 tm-20 -113.13 127.3 56.16 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.982 -163.2 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.533 ' NE2' ' HG3' ' A' ' 46' ' ' GLU . 86.3 t60 -121.48 130.24 53.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.675 160.279 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.533 ' HG3' ' NE2' ' A' ' 45' ' ' HIS . 3.2 mm-40 58.27 34.73 24.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.074 171.698 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 36.65 70.65 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 171.642 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.06 128.2 9.18 Favored Pre-proline 0 C--O 1.242 0.667 0 CA-C-O 121.655 0.741 . . . . 0.0 109.612 162.358 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.477 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 14.6 Cg_endo -63.59 159.9 38.65 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 C-N-CA 122.567 2.178 . . . . 0.0 113.57 174.45 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 72.9 m-85 -151.47 -174.11 4.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.758 165.761 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.8 m -57.63 123.56 16.04 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 113.569 -1.65 . . . . 0.0 110.229 164.362 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -60.73 -28.65 68.84 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.11 -1.404 . . . . 0.0 109.931 165.095 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' CB ' ' A' ' 57' ' ' SER . 22.3 m-70 -155.89 160.27 30.93 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 114.862 -1.063 . . . . 0.0 108.982 159.255 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -74.57 -20.24 16.26 Favored 'Cis proline' 0 C--N 1.354 0.839 0 C-N-CA 122.803 -1.749 . . . . 0.0 113.699 -11.994 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.599 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 81.9 m -58.91 -56.1 26.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.808 -155.449 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.48 ' CE1' ' CD2' ' A' ' 60' ' ' PHE . 7.0 t80 -61.06 -45.33 95.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.293 -179.772 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.431 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 17.2 t -61.02 -15.4 31.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.547 175.407 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . -85.92 -54.67 4.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.184 -173.21 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.718 ' HE3' ' HD3' ' A' ' 32' ' ' LYS . 2.3 mtm -100.09 -35.3 9.73 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.248 -172.204 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.491 ' CE1' ' CG ' ' A' ' 45' ' ' HIS . 54.3 m-85 -107.36 -169.72 1.58 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.173 165.337 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -129.0 -152.23 7.62 Favored Glycine 0 CA--C 1.542 1.771 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 -174.534 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -56.14 -87.29 0.01 OUTLIER 'Trans proline' 0 N--CA 1.487 1.117 0 C-N-CA 122.371 2.048 . . . . 0.0 113.469 -171.104 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.502 ' HD2' ' CE2' ' A' ' 65' ' ' PHE . 1.5 mmmt -111.82 -78.56 0.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.427 176.988 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.41 -102.0 0.33 Allowed Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 166.973 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.502 ' CE2' ' HD2' ' A' ' 63' ' ' LYS . 2.0 m-85 60.62 76.01 0.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.184 -0.508 . . . . 0.0 110.595 -172.435 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 61.77 78.81 0.15 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 170.283 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.96 33.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.269 -0.466 . . . . 0.0 110.423 170.251 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.27 97.1 1.72 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 169.411 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.0 145.18 7.75 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 -170.661 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.49 -162.98 0.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.256 -0.472 . . . . 0.0 110.369 -176.115 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.43 75.65 0.38 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.722 -168.529 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.89 -28.63 9.98 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.462 -177.765 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 71.99 -60.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.415 170.775 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 59.0 m 69.99 88.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.416 169.693 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -93.91 -78.29 0.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.277 168.815 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.551 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.319 169.234 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.486 1.048 0 N-CA-C 113.429 0.511 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.49 133.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.439 169.24 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.525 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 27.7 t -89.58 133.04 35.21 Favored Pre-proline 0 C--O 1.243 0.753 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.166 -165.36 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 6.3 Cg_exo -73.06 -26.78 14.67 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.246 2.631 . . . . 0.0 113.44 171.533 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 -64.41 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.297 -164.712 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -92.5 -28.9 16.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.371 -164.792 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 73.72 58.79 0.09 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.525 -165.832 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.83 -168.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.838 158.245 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -108.82 149.57 28.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.624 160.772 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.935 HG22 ' CD2' ' A' ' 24' ' ' HIS . 65.5 t -103.5 117.89 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.595 -167.662 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -91.88 55.12 2.59 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.951 -156.072 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 61.59 -79.09 0.02 OUTLIER 'General case' 0 C--N 1.34 0.155 0 CA-C-N 113.976 -1.466 . . . . 0.0 110.358 178.477 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.18 -2.12 36.11 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.512 -163.068 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.69 13.96 30.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.251 176.682 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -83.78 153.48 24.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.258 -164.974 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.601 ' CG2' HD22 ' A' ' 28' ' ' LEU . 17.2 m -148.26 122.18 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.741 157.362 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 88.4 m -98.59 135.81 39.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.408 -162.197 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.455 ' OG ' HD22 ' A' ' 19' ' ' LEU . 21.8 t -178.0 137.39 0.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.586 -167.594 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.9 mm? 60.23 25.92 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.548 -173.039 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.58 -24.2 24.42 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 165.868 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -127.33 139.72 52.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 114.703 -0.749 . . . . 0.0 110.029 -177.251 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.5 OUTLIER -68.86 -179.17 1.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.338 -161.394 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 60.3 m95 -145.77 -177.6 5.67 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 113.59 -1.641 . . . . 0.0 109.396 178.659 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.935 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -100.49 143.73 30.32 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.616 168.83 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 21.7 ttp85 -63.57 -53.22 53.28 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.81 179.13 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 8.7 Cg_endo -53.25 -13.41 3.22 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 122.459 2.106 . . . . 0.0 113.612 172.296 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.8 m -96.38 -64.26 1.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.328 -179.171 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.648 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.8 OUTLIER -64.85 91.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.398 -166.418 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.85 170.68 17.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.234 168.638 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.5 t -60.79 150.62 32.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.326 168.373 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 1.9 mm-40 -118.74 25.7 10.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.732 160.063 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.47 -59.99 1.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.172 167.902 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -102.3 -48.44 4.19 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.645 -167.759 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.42 56.45 0.51 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 167.284 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -131.01 137.52 49.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.39 167.386 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.4 m -60.73 153.16 24.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.442 174.02 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 12.5 mt -113.54 153.38 28.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.404 -165.424 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.477 HG22 ' N ' ' A' ' 39' ' ' SER . 93.8 m -68.72 166.58 17.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.475 -178.025 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.477 ' N ' HG22 ' A' ' 38' ' ' THR . 66.4 m -62.4 77.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.415 170.175 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.3 55.2 3.53 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 172.291 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.36 11.53 4.98 Favored Glycine 0 CA--C 1.522 0.519 0 CA-C-N 115.102 -0.549 . . . . 0.0 111.777 166.172 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.648 ' CE1' HD11 ' A' ' 28' ' ' LEU . 3.9 p80 -99.45 -169.26 1.73 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 114.84 -0.68 . . . . 0.0 110.47 177.49 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -130.91 171.65 12.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.339 168.91 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -147.76 138.35 23.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.05 -170.879 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -121.61 114.79 21.67 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.437 -0.801 . . . . 0.0 108.858 164.797 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.73 -148.11 0.44 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.522 -152.408 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.45 ' O ' ' HD3' ' A' ' 49' ' ' PRO . . . -95.35 35.0 4.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 166.923 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm -107.37 87.55 3.36 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 121.211 0.529 . . . . 0.0 109.756 169.229 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.0 Cg_endo -62.85 147.9 94.09 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 122.526 2.151 . . . . 0.0 113.552 -174.847 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.534 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 7.5 m-85 -144.95 -165.78 2.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.922 162.095 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 99.5 m -59.11 -178.01 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.703 171.534 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.84 -32.89 11.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.178 164.586 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.52 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.2 m-70 -164.75 165.97 11.75 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.03 -0.987 . . . . 0.0 109.541 171.472 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.52 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 Cg_endo -69.61 -6.48 9.21 Favored 'Cis proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.635 -1.819 . . . . 0.0 113.604 -11.515 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 63.5 m -60.28 -51.05 71.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.425 -162.001 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -60.73 -37.42 81.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.416 -168.136 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 60.1 p -86.91 -21.66 26.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.515 -173.817 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.358 -170.232 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.3 ttt -105.21 -34.54 7.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.312 -171.621 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -96.33 29.5 2.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.405 -169.615 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.45 179.8 30.78 Favored Glycine 0 CA--C 1.542 1.733 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 176.245 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -58.2 -80.68 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.997 0 C-N-CA 122.55 2.167 . . . . 0.0 113.581 -173.543 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 171.9 1.14 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.358 -169.569 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -130.77 -136.52 3.97 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 170.494 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -143.56 175.15 10.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.369 -0.415 . . . . 0.0 110.398 170.16 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -81.9 108.48 2.91 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 178.257 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.2 mmm-85 64.74 -171.67 0.18 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.404 178.148 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 166.83 166.5 26.03 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 170.283 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.09 111.49 0.32 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 170.344 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -140.87 -45.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.451 -0.374 . . . . 0.0 110.192 -169.868 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.41 -171.07 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.042 -168.96 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.444 ' HG ' ' HE1' ' A' ' 75' ' ' PHE . 1.5 m 65.7 113.55 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.334 169.185 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.6 158.15 43.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.41 169.792 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.8 m 69.65 -80.62 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.427 -178.273 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.444 ' HE1' ' HG ' ' A' ' 72' ' ' SER . 0.2 OUTLIER 65.03 158.81 0.1 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.33 169.671 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.552 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.401 178.078 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.242 0 N-CA-C 113.369 0.488 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 2.1 ttmm 63.77 162.34 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.218 165.331 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.8 t -80.6 131.27 61.6 Favored Pre-proline 0 C--O 1.243 0.737 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.486 -163.256 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.605 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.2 Cg_exo -70.4 -9.11 25.17 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 123.223 2.616 . . . . 0.0 113.504 170.328 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -102.19 -72.55 0.68 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.332 -172.38 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -91.99 -21.85 20.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.524 -160.157 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 t0 73.63 61.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.507 -167.164 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.92 166.65 23.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.076 159.447 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.532 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -85.4 148.72 25.87 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.42 171.92 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.924 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -110.16 116.85 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.742 -160.341 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -168.39 1.17 Allowed 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -74.28 -84.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.509 -165.973 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.78 -10.39 58.2 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.193 -0.603 . . . . 0.0 111.713 -159.158 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -104.98 42.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.963 169.621 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.35 149.12 25.65 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.396 176.324 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.838 HG21 HD22 ' A' ' 28' ' ' LEU . 18.5 m -148.85 144.71 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.065 162.05 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 m -114.99 135.85 53.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.378 -168.822 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.8 t -177.79 128.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.366 -168.859 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.2 mm? 60.17 22.11 11.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.423 -170.77 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.4 -24.4 27.6 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 164.524 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.4 137.37 51.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 114.76 -0.72 . . . . 0.0 110.24 -177.192 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.67 178.51 5.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.32 -163.388 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.605 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 41.6 m95 -146.46 177.4 9.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.59 -177.311 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.924 ' CD2' HG22 ' A' ' 10' ' ' VAL . 42.7 m80 -98.21 137.55 36.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.463 169.501 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 10.1 ttp85 -60.8 -47.28 96.22 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.878 -170.702 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.6 Cg_exo -54.75 -35.77 88.71 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 122.576 2.184 . . . . 0.0 113.544 170.929 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.34 -54.2 13.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.317 -172.967 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HG21 ' A' ' 16' ' ' VAL . 2.1 tp -62.67 96.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.322 -166.243 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -139.82 177.88 7.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 166.863 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.4 t -61.37 170.33 1.83 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.114 164.553 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.576 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 1.8 pt-20 -140.45 20.85 2.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.652 160.08 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.488 ' HE2' ' CD2' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -100.2 -57.65 2.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.271 167.577 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.9 p -96.62 -49.83 4.96 Favored 'General case' 0 CA--C 1.524 -0.05 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.525 -170.895 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.05 59.73 0.61 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 169.931 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.68 139.17 27.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.058 0.456 . . . . 0.0 110.457 166.857 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.585 HG22 ' H ' ' A' ' 37' ' ' LEU . 1.8 m -61.49 171.62 1.42 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.437 -173.571 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.703 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.8 mt -129.05 -177.82 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.366 -170.858 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 40' ' ' GLY . 4.8 t -109.31 -169.44 1.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.548 -170.154 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.5 t -61.32 -25.26 67.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.342 -170.059 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.513 ' H ' HG23 ' A' ' 38' ' ' THR . . . 173.37 70.52 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 169.79 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -123.57 10.7 8.53 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.615 -0.594 . . . . 0.0 111.615 166.134 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.703 ' CB ' HD13 ' A' ' 37' ' ' LEU . 6.1 p80 -90.63 -169.5 2.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.441 173.361 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -137.7 172.59 12.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.328 167.632 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.543 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -128.57 147.76 50.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.964 166.758 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.495 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 86.0 t60 -84.27 -79.37 0.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.837 170.112 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -171.12 73.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.928 167.738 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 155.88 -45.75 0.52 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.545 -174.652 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 2.4 mptp? -143.98 138.61 15.2 Favored Pre-proline 0 C--O 1.242 0.665 0 CA-C-O 121.489 0.661 . . . . 0.0 109.87 -170.927 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.59 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 19.7 Cg_endo -64.18 147.15 91.33 Favored 'Trans proline' 0 N--CA 1.486 1.046 0 C-N-CA 122.658 2.238 . . . . 0.0 113.58 171.012 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.576 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 11.7 m-85 -139.49 -168.12 2.4 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.868 163.814 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 57.3 m -58.42 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.84 -1.527 . . . . 0.0 110.548 166.959 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -102.91 -30.26 10.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.132 161.876 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.512 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 41.3 m-70 -168.46 165.48 7.46 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.412 171.646 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.509 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -70.13 -5.76 9.63 Favored 'Cis proline' 0 N--CA 1.482 0.816 0 C-N-CA 122.576 -1.843 . . . . 0.0 113.741 -10.825 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 71.6 m -60.07 -41.33 92.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.554 -161.467 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.31 -39.59 94.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.381 -169.335 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.512 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 28.2 m -98.65 -19.34 17.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.328 -168.046 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.22 -53.24 10.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.274 -167.811 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -86.49 -42.18 13.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.37 -168.339 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.495 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 1.3 m-85 -62.83 88.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.325 -167.542 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.478 ' H ' ' HD3' ' A' ' 62' ' ' PRO . . . 151.7 61.13 0.01 OUTLIER Glycine 0 CA--C 1.544 1.903 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -171.227 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.584 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 5.5 Cg_endo -59.3 -88.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.487 1.117 0 C-N-CA 122.449 2.099 . . . . 0.0 113.51 -169.169 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -147.44 -175.21 4.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.344 -168.133 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -143.23 -110.02 0.73 Allowed Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 169.409 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 66.95 -80.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.366 169.509 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.01 125.41 32.32 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -169.932 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.509 ' H ' ' HD2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -118.07 -170.17 1.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.383 . . . . 0.0 110.363 170.193 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.9 -68.57 1.61 Allowed Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 170.231 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 74.29 -91.02 0.72 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -170.137 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.48 -77.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.224 -0.488 . . . . 0.0 110.421 -177.087 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 19.0 mp0 58.95 -84.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.629 -167.351 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 61.54 95.43 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.463 -168.818 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.03 -171.4 3.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.431 177.194 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 t -130.36 -161.32 1.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.399 -170.044 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.32 126.66 28.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.391 -169.979 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.24 0.601 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.439 170.176 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.525 ' H3 ' ' CG ' ' A' ' 22' ' ' ASP . 2.2 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 113.574 0.567 . . . . 0.0 113.574 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 8.4 mmtt -138.87 139.86 38.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.467 -170.38 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 25.1 t -97.76 122.5 54.79 Favored Pre-proline 0 C--O 1.243 0.711 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.202 -165.329 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 8.3 Cg_endo -61.78 -27.64 80.92 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 122.538 2.159 . . . . 0.0 113.024 172.1 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.521 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.75 -55.43 3.57 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.666 -155.977 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.9 p -92.03 -27.61 17.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.395 -177.488 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.95 68.29 0.1 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.504 -165.484 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 -167.69 1.86 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.017 160.394 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.425 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -110.34 149.54 30.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.114 162.419 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.923 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.5 t -108.68 130.52 61.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.813 -161.553 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.419 ' HB3' ' HG2' ' A' ' 14' ' ' GLU . 3.8 t80 -90.67 178.43 6.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.359 -178.832 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -64.11 -83.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.281 -167.0 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.8 -1.95 10.74 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.554 -161.872 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' HB3' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -102.77 18.32 21.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.21 178.843 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -98.09 146.51 25.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.276 -165.358 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 28' ' ' LEU . 14.5 m -143.3 120.92 6.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.891 156.515 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 33.3 m -90.31 132.29 35.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.383 -178.559 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -167.94 124.32 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.155 -162.004 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.666 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.28 24.84 14.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.574 -173.528 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 99.13 -25.43 28.25 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 161.221 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -121.77 138.54 54.33 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 114.848 -0.676 . . . . 0.0 109.976 178.569 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.525 ' CG ' ' H3 ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -73.06 178.6 4.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.37 -160.489 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 63.3 m95 -143.52 177.5 8.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.802 -176.377 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.923 ' CD2' HG22 ' A' ' 10' ' ' VAL . 43.2 m80 -102.43 139.48 37.97 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.307 168.056 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.563 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 ttt180 -61.04 -51.27 80.3 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.779 -168.242 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.563 ' HD2' ' N ' ' A' ' 25' ' ' ARG . 10.3 Cg_endo -56.82 -28.97 79.31 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.489 2.126 . . . . 0.0 113.518 173.036 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -67.31 -64.64 0.81 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.311 177.511 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -64.57 94.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.357 -163.444 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.19 173.28 9.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.227 167.516 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -60.63 -178.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.187 166.259 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.531 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -135.01 18.8 3.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.736 160.45 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.6 -45.39 1.48 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.536 -168.096 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -107.12 -32.13 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.75 176.057 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.458 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 85.85 64.39 1.49 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 177.382 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.1 tttp -150.15 145.83 26.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.038 -0.581 . . . . 0.0 110.422 -178.537 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.73 153.31 43.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.461 -174.707 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.494 ' HB2' HD23 ' A' ' 28' ' ' LEU . 14.4 mt -122.06 141.12 51.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.339 -168.179 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.528 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -60.88 -175.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.442 -169.348 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 38' ' ' THR . 11.8 p -67.61 72.55 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.407 169.557 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 18' ' ' SER . . . 72.25 57.72 5.49 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 172.13 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -125.53 12.15 7.47 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 164.315 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.788 ' NE2' HD21 ' A' ' 28' ' ' LEU . 2.8 p80 -102.0 -170.31 1.8 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 114.606 -0.797 . . . . 0.0 110.411 176.104 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.81 ' HB2' ' OD1' ' A' ' 52' ' ' ASN . . . -126.9 -174.35 3.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.34 169.902 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 1.7 tm-20 -164.94 146.26 7.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.971 -168.664 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.486 ' CE1' ' CE1' ' A' ' 60' ' ' PHE . 60.8 t60 -113.73 -51.34 2.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.755 -168.161 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -171.15 99.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.101 165.9 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.25 12.66 32.35 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.649 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG2' ' HG3' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -141.8 86.99 10.27 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 114.914 -0.643 . . . . 0.0 109.785 -175.632 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.494 ' HB3' ' CE1' ' A' ' 42' ' ' HIS . 12.1 Cg_endo -60.94 147.26 96.13 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.518 2.145 . . . . 0.0 113.608 -176.198 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 4.3 m-85 -135.51 -178.55 5.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.015 164.464 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 85.9 m -59.31 -178.42 0.06 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.652 172.331 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.81 ' OD1' ' HB2' ' A' ' 43' ' ' ALA . 1.1 m-20 -97.37 -34.88 10.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.999 164.481 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.0 m-70 -154.73 173.94 4.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-O 122.135 0.969 . . . . 0.0 109.344 165.969 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 23.6 Cg_endo -62.29 -12.93 3.62 Favored 'Cis proline' 0 N--CA 1.498 1.743 0 C-N-CA 121.312 -2.37 . . . . 0.0 112.505 -20.699 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.4 m -58.15 -48.3 80.69 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.85 -158.628 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.76 -41.02 94.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.457 -168.81 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -77.76 -18.92 55.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.55 -176.911 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.24 47.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.215 -168.161 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.9 ttp -116.14 -30.84 5.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.37 -169.245 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.486 ' CE1' ' CE1' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -113.73 94.92 5.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.414 -169.938 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.405 ' HA3' ' HD3' ' A' ' 62' ' ' PRO . . . -74.39 -104.54 0.09 OUTLIER Glycine 0 CA--C 1.543 1.811 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 174.48 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.405 ' HD3' ' HA3' ' A' ' 61' ' ' GLY . 2.7 Cg_exo -62.1 -86.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 122.566 2.178 . . . . 0.0 113.523 -173.733 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.11 176.98 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.325 -171.459 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.39 170.05 5.68 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.547 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 71.85 110.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.379 169.758 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.15 -19.96 15.24 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 169.717 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -174.99 109.42 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.34 -0.43 . . . . 0.0 110.381 169.988 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -157.16 136.14 4.76 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 -178.278 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.67 84.02 0.07 OUTLIER Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 170.268 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -137.74 14.85 2.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.397 -0.402 . . . . 0.0 110.304 170.249 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 58.48 179.66 0.07 Allowed 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.681 -168.461 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.4 140.96 28.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.419 -169.301 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -149.03 158.52 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.318 169.947 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -63.66 -28.76 70.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.385 -170.182 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.18 25.06 11.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.315 -169.977 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.521 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.376 170.086 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.486 1.083 0 N-CA-C 113.418 0.507 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -148.23 165.51 30.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.388 -168.363 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 11.7 t -78.93 135.83 58.68 Favored Pre-proline 0 C--O 1.244 0.803 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.434 -162.489 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.613 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 4.6 Cg_exo -69.85 -26.39 27.19 Favored 'Trans proline' 0 N--CA 1.484 0.966 0 C-N-CA 123.437 2.758 . . . . 0.0 113.358 166.826 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.401 ' HE3' ' NZ ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -85.97 -65.85 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.365 -167.296 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 p -97.4 -25.84 15.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.577 -163.965 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.7 t70 72.77 69.7 0.13 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.504 -164.544 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 0.2 OUTLIER -129.6 -168.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.158 163.22 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.69 148.37 28.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.406 160.851 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.922 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.4 t -107.71 112.45 40.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.902 -165.919 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CZ ' ' A' ' 12' ' ' PHE . 17.7 t80 -66.95 160.91 25.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.354 176.342 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CZ ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -62.24 -76.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.221 -167.868 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.76 -0.31 6.88 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.45 -162.553 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -105.7 16.59 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.279 177.064 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.56 157.8 16.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.263 -166.148 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.549 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.89 123.09 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.82 160.393 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 84.9 m -100.62 135.28 42.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.443 -167.259 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.459 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 6.9 t -177.91 130.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.438 -166.061 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.4 mm? 60.04 37.69 21.03 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.663 -175.158 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.22 17.61 46.38 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 165.709 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -151.33 123.15 8.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.447 -0.376 . . . . 0.0 110.039 168.019 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.419 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 6.7 m-20 -63.56 -179.34 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.351 -162.703 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.613 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 50.4 m95 -145.79 169.68 18.04 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.708 -178.077 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.922 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -92.85 144.02 25.69 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.52 170.245 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.542 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.0 ttp85 -61.16 -49.51 88.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 -169.833 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 2.9 Cg_exo -57.8 -33.68 97.23 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 122.692 2.261 . . . . 0.0 113.504 172.728 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.17 -55.81 8.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.28 -171.194 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.688 HD11 ' CE1' ' A' ' 42' ' ' HIS . 1.9 tp -60.7 87.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.345 -167.054 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.401 ' NZ ' ' HE3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -129.08 153.39 47.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.224 -170.874 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 4.7 t -65.6 171.38 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.441 164.688 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.537 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 38.6 tt0 -121.54 -21.64 6.16 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.707 173.322 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -94.7 -39.42 10.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.501 -167.53 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.9 p -105.98 -42.49 5.1 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.0 174.701 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.462 ' H ' ' HB3' ' A' ' 30' ' ' CYS . . . 86.41 58.04 2.01 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 175.601 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.28 139.2 49.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.421 . . . . 0.0 110.364 167.792 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 158.27 18.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.32 -176.645 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 7.6 mt -119.96 137.04 54.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.434 -166.235 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 39' ' ' SER . 39.4 m -67.61 169.76 8.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.523 -178.571 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG22 ' A' ' 38' ' ' THR . 2.3 m -69.55 76.67 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.436 -175.27 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.28 56.64 1.44 Allowed Glycine 0 CA--C 1.529 0.918 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 169.633 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -137.8 10.72 3.68 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-N 114.908 -0.646 . . . . 0.0 111.824 166.972 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.688 ' CE1' HD11 ' A' ' 28' ' ' LEU . 2.8 p80 -103.54 -170.45 1.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.301 -0.449 . . . . 0.0 110.328 -177.102 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.847 ' HB2' ' ND2' ' A' ' 52' ' ' ASN . . . -132.51 -171.72 2.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.061 165.19 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -170.98 154.49 4.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.972 -172.624 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.516 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 14.4 p80 -105.86 -169.3 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.067 160.006 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -62.53 81.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.272 -177.424 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 124.18 -33.8 3.73 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 168.651 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.516 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 0.9 OUTLIER -124.51 109.1 28.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-O 121.574 0.702 . . . . 0.0 109.735 -165.199 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 9.5 Cg_endo -63.7 148.41 92.16 Favored 'Trans proline' 0 N--CA 1.483 0.903 0 C-N-CA 122.651 2.234 . . . . 0.0 113.642 173.122 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 5.1 m-85 -135.44 -168.03 2.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.815 165.684 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 52.8 m -58.45 -169.45 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.974 -1.467 . . . . 0.0 110.489 164.184 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.847 ' ND2' ' HB2' ' A' ' 43' ' ' ALA . 0.4 OUTLIER -100.77 -37.67 8.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.23 163.046 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 35.4 m-70 -157.79 172.8 5.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-O 122.195 0.998 . . . . 0.0 109.456 167.154 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 27.0 Cg_endo -63.59 -11.53 4.19 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.486 -2.297 . . . . 0.0 112.516 -19.081 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 58.6 m -58.27 -40.57 82.22 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.71 -158.615 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -61.12 -30.99 70.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.276 -172.714 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.3 t -108.26 24.16 13.43 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.488 176.468 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -102.7 -64.65 1.05 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.246 -175.28 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.426 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 3.8 ttt -85.13 -19.64 31.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.414 -166.15 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.99 94.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.448 -167.109 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.468 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . -169.06 49.68 0.22 Allowed Glycine 0 CA--C 1.543 1.805 0 N-CA-C 109.811 -1.316 . . . . 0.0 109.811 171.884 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 9.7 Cg_endo -61.76 -87.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.567 2.178 . . . . 0.0 113.593 -171.961 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.46 87.4 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.343 -167.999 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 174.16 113.56 0.32 Allowed Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -170.207 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.2 t80 176.2 158.87 0.28 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.399 -0.401 . . . . 0.0 110.335 169.733 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.91 152.51 39.6 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 170.296 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -109.6 32.91 4.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.302 -169.787 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -69.99 -27.24 73.3 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 -179.207 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 126.49 -162.0 20.72 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.471 -1.051 . . . . 0.0 110.471 170.339 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -168.96 94.12 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.417 -0.391 . . . . 0.0 110.252 169.854 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -151.34 88.61 1.45 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.061 168.753 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p 61.32 170.48 0.11 Allowed 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.489 -177.966 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 178.44 168.27 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.415 178.662 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 74' ' ' THR . 8.8 t 178.5 91.43 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.384 170.154 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 178.47 85.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.415 170.088 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.575 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.392 -170.023 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 113.636 0.591 . . . . 0.0 113.636 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.94 168.31 20.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.413 177.941 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 12.6 t -77.53 130.93 72.59 Favored Pre-proline 0 C--O 1.246 0.869 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.554 -163.092 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.636 ' HG3' ' HG3' ' A' ' 21' ' ' LYS . 4.1 Cg_exo -68.91 -14.82 39.47 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 C-N-CA 123.23 2.62 . . . . 0.0 113.397 168.679 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.56 ' HE2' ' HD2' ' A' ' 49' ' ' PRO . 8.9 tptp -95.68 -72.36 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.235 -169.545 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -91.74 -23.17 19.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.568 -163.098 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 74.12 55.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 -167.621 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.27 176.91 6.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.699 155.915 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -95.85 151.26 19.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.783 171.997 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.926 HG22 ' CD2' ' A' ' 24' ' ' HIS . 70.5 t -113.25 111.05 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.852 -163.535 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.33 -167.99 1.04 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.405 -173.779 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -62.56 -83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.203 -164.934 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.58 -15.41 59.25 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.609 -163.233 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -95.87 41.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.98 174.348 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.4 140.88 47.69 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.598 170.781 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 134.32 61.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.838 159.285 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -103.01 139.06 39.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.422 -169.039 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.485 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 3.6 t -177.63 122.55 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.193 -165.965 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.685 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.23 32.6 20.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.506 -171.218 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.42 61.69 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 164.163 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HG3' ' HG3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -145.15 125.52 13.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 164.204 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.444 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -66.94 179.81 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.411 -161.028 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.1 m95 -148.34 175.81 10.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 114.205 -1.361 . . . . 0.0 109.724 -176.916 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.926 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.2 m80 -95.35 150.26 20.46 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.563 172.24 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.442 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.04 -50.09 86.12 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.873 -167.594 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -65.51 -36.19 35.28 Favored 'Trans proline' 0 N--CA 1.483 0.89 0 C-N-CA 122.696 2.264 . . . . 0.0 113.526 176.267 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.2 -47.12 87.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.201 -165.174 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.959 HD21 ' NE2' ' A' ' 42' ' ' HIS . 5.0 tp -59.96 92.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.402 -159.774 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.559 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -132.29 165.11 24.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.252 -171.257 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.9 t -61.4 179.39 0.22 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.307 172.333 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.487 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 2.6 tp10 -143.93 22.99 1.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.967 162.605 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.555 ' HE3' ' HB2' ' A' ' 59' ' ' MET . 0.8 OUTLIER -128.79 -37.23 1.76 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.719 -171.426 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 25.4 p -106.97 -48.3 3.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.483 165.938 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.99 58.32 0.88 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -169.648 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.6 141.39 46.61 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 114.966 -0.617 . . . . 0.0 110.459 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.559 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -74.66 152.67 39.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.405 -170.455 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.52 ' HG ' ' HA ' ' A' ' 29' ' ' LYS . 22.9 mt -117.87 161.13 20.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.336 -168.529 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -103.99 -175.01 2.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.367 -167.511 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 1.5 p -61.04 -18.68 59.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.383 -167.823 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.69 68.32 0.03 OUTLIER Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 169.548 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.08 10.55 5.93 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 167.356 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.959 ' NE2' HD21 ' A' ' 28' ' ' LEU . 3.8 p80 -93.0 -169.74 2.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.241 -0.48 . . . . 0.0 110.415 176.793 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -131.66 -168.79 2.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.142 168.286 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.519 ' CB ' ' HA ' ' A' ' 49' ' ' PRO . 0.1 OUTLIER -166.67 160.61 15.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.049 168.144 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.492 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.5 t60 -132.44 72.06 1.49 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.96 -177.335 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 58.4 87.17 0.08 Allowed 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.918 -179.603 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.81 -21.27 46.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 165.086 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -132.51 96.38 19.01 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.669 0.747 . . . . 0.0 109.866 -167.991 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.56 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 16.1 Cg_endo -59.49 142.67 99.29 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 122.256 1.97 . . . . 0.0 113.627 175.752 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 73.6 m-85 -135.72 -177.1 4.52 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.017 176.461 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 65.4 m -58.98 -178.21 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.526 168.344 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.78 -27.95 14.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.018 160.976 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 51.8 m-70 -169.52 166.53 5.78 Favored Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.497 172.119 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.522 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 Cg_endo -69.16 -6.75 8.6 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.574 -1.844 . . . . 0.0 113.673 -12.071 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.517 ' HA ' ' HB2' ' A' ' 58' ' ' ALA . 66.4 m -60.52 -49.56 77.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.401 -162.727 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.92 -38.07 84.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.418 -171.455 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.444 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -106.07 32.91 4.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.496 170.208 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.517 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . -78.45 -66.81 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.284 169.742 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.555 ' HB2' ' HE3' ' A' ' 32' ' ' LYS . 2.5 ttm -108.64 -28.53 9.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.411 -169.778 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.492 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 3.7 m-85 -77.53 85.37 3.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.336 -170.016 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 148.15 66.1 0.01 OUTLIER Glycine 0 CA--C 1.544 1.854 0 N-CA-C 109.786 -1.325 . . . . 0.0 109.786 -171.435 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -54.11 101.36 0.07 OUTLIER 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 122.579 2.186 . . . . 0.0 113.534 -172.338 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.55 -36.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.371 -170.318 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.79 -91.78 0.03 OUTLIER Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.172 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.7 124.44 23.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.242 170.174 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.2 97.88 0.67 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 170.142 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.435 ' HG3' ' H ' ' A' ' 68' ' ' GLY . 10.0 ptt85 -103.32 -60.45 1.56 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.333 170.21 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.435 ' H ' ' HG3' ' A' ' 67' ' ' ARG . . . 176.04 127.62 1.05 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 178.694 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -155.22 172.52 33.47 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -178.46 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.11 -60.29 1.9 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.439 -0.381 . . . . 0.0 110.341 169.835 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -123.79 -74.58 0.61 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.049 -168.965 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -126.76 -75.21 0.58 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.388 169.325 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' ' 74' ' ' THR . 27.6 m80 -155.47 -80.38 0.08 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.405 170.039 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.58 HG23 ' O ' ' A' ' 73' ' ' HIS . 4.6 p -164.33 -86.81 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.446 170.288 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -118.12 -43.0 2.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.326 170.019 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.514 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.415 -178.292 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.487 1.09 0 N-CA-C 113.479 0.53 . . . . 0.0 113.479 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HD2' ' CG ' ' A' ' 9' ' ' GLU . 1.7 mmtp 63.71 156.68 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.343 170.614 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.4 t -80.46 132.33 59.04 Favored Pre-proline 0 C--O 1.244 0.787 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.408 -162.006 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.615 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 5.0 Cg_exo -69.06 -19.78 38.99 Favored 'Trans proline' 0 N--CA 1.485 1.014 0 C-N-CA 123.267 2.644 . . . . 0.0 113.312 167.128 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -70.86 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.353 -166.304 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.2 p -91.19 -24.07 20.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 -165.142 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 73.45 58.3 0.1 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.534 -167.48 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.5 -168.88 1.56 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.891 158.904 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' CG ' ' HD2' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -109.76 152.09 26.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.574 160.219 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.925 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.7 t -107.59 110.33 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.746 -163.845 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -74.43 178.23 5.39 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.151 -179.63 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -61.4 -84.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.567 -165.071 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.34 -6.49 35.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.861 -158.802 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 17.71 11.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.287 -176.858 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.441 ' H ' ' HD2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -85.2 154.29 22.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.246 -163.971 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 28' ' ' LEU . 11.4 m -148.31 121.88 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.254 161.025 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.7 m -102.5 135.4 44.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.389 -163.921 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.496 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 17.7 t -177.99 132.55 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.408 -166.625 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 19' ' ' LEU . 3.2 mm? 60.1 34.68 21.27 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.65 -177.276 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.47 18.17 50.03 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 167.268 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -150.34 125.08 9.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.053 166.703 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.86 -179.77 0.3 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.448 -162.592 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.4 m95 -145.91 -172.14 3.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 114.066 -1.425 . . . . 0.0 109.446 179.773 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.925 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.9 m80 -103.16 148.86 25.24 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.544 169.39 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.566 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 30.4 ttt180 -65.56 -50.36 56.96 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.79 -174.225 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.2 Cg_endo -57.31 -22.81 51.27 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 122.531 2.154 . . . . 0.0 113.542 174.152 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -84.16 -57.91 2.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.299 -170.757 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.805 HD11 ' CE1' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -60.79 93.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.456 -166.461 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.5 mtpm? -148.89 150.8 33.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 -174.912 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 6.5 t -66.54 136.08 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.198 161.896 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -115.22 33.41 5.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.044 167.559 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.16 -46.82 3.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.679 167.676 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.3 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.85 179.982 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.52 51.61 3.82 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.456 -1.057 . . . . 0.0 110.456 169.063 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -128.39 128.38 44.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.109 -0.546 . . . . 0.0 110.405 -176.268 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.469 ' HA ' ' CG ' ' A' ' 29' ' ' LYS . 55.8 m -60.98 139.22 58.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.298 168.563 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HB3' ' HB3' ' A' ' 42' ' ' HIS . 13.5 mt -104.8 166.72 10.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.394 -166.359 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.558 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -94.2 -172.01 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.37 -167.935 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.558 ' H ' HG22 ' A' ' 38' ' ' THR . 6.9 p -61.02 -18.35 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.368 -168.141 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.61 0.02 OUTLIER Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 169.05 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.37 10.58 9.9 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.661 -0.576 . . . . 0.0 111.661 165.938 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.805 ' CE1' HD11 ' A' ' 28' ' ' LEU . 7.3 p80 -94.57 -169.91 2.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.422 177.614 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.716 ' HB2' ' ND2' ' A' ' 52' ' ' ASN . . . -137.61 -164.25 1.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.167 168.634 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -160.18 148.34 16.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.231 174.329 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -128.0 70.32 1.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.884 -166.642 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 58.36 89.64 0.05 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.898 -178.473 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.75 -28.86 12.54 Favored Glycine 0 CA--C 1.527 0.841 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 164.847 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HG3' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -141.98 137.42 15.94 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 121.439 0.637 . . . . 0.0 109.779 -173.553 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.9 Cg_endo -63.57 150.83 87.53 Favored 'Trans proline' 0 N--CA 1.486 1.05 0 C-N-CA 122.649 2.233 . . . . 0.0 113.505 169.067 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 86.1 m-85 -141.05 -164.9 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.949 162.799 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 13.5 m -57.43 -177.52 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.641 167.602 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.716 ' ND2' ' HB2' ' A' ' 43' ' ' ALA . 0.3 OUTLIER -100.38 -26.12 13.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.844 158.351 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.511 ' CE1' ' HB2' ' A' ' 57' ' ' SER . 50.6 m-70 -170.82 166.22 4.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 CA-C-N 114.645 -1.162 . . . . 0.0 109.343 172.178 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 53' ' ' HIS . 8.2 Cg_endo -71.08 -7.84 12.62 Favored 'Cis proline' 0 N--CA 1.482 0.838 0 C-N-CA 122.656 -1.81 . . . . 0.0 113.604 -12.279 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.501 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 62.8 m -60.06 -32.42 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.534 -160.87 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -77.19 -36.08 55.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.334 -172.538 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.511 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 19.6 m -93.55 24.04 4.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.467 169.813 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.478 ' HB2' ' HA ' ' A' ' 55' ' ' CYS . . . -81.7 -54.09 5.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.345 179.677 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.444 ' HB3' ' CE1' ' A' ' 60' ' ' PHE . 7.2 ttm -108.32 -17.99 13.87 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.71 -173.798 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.444 ' CE1' ' HB3' ' A' ' 59' ' ' MET . 2.0 m-85 -132.23 -169.69 2.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.006 -164.256 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.532 ' N ' ' HD3' ' A' ' 62' ' ' PRO . . . 72.69 51.68 11.21 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -175.069 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 61' ' ' GLY . 8.1 Cg_endo -61.08 71.39 0.08 OUTLIER 'Trans proline' 0 N--CA 1.486 1.069 0 C-N-CA 122.571 2.18 . . . . 0.0 113.508 168.014 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -88.39 -19.05 27.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.402 -167.535 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.29 63.19 4.18 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 -169.391 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 62' ' ' PRO . 8.8 p90 173.52 168.46 0.17 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.272 168.96 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -151.11 -56.33 0.01 OUTLIER Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -170.54 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -113.2 87.63 2.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.437 -0.382 . . . . 0.0 110.378 -170.577 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -166.96 124.84 1.26 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.124 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.37 76.06 0.19 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -96.5 -39.66 9.45 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.117 -0.542 . . . . 0.0 110.239 -176.129 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -63.29 124.94 22.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.05 -168.9 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.14 132.15 20.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.424 169.404 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -86.92 140.65 29.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.365 -169.857 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 75' ' ' PHE . 3.9 t -71.41 -55.27 8.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.468 169.938 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 76' ' ' LYS . 22.7 p90 -165.09 -37.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.4 169.65 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.487 ' N ' ' CD1' ' A' ' 75' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.573 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.456 170.051 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.441 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 3.7 Cg_exo . . . . . 0 N--CA 1.485 0.986 0 N-CA-C 113.513 0.543 . . . . 0.0 113.513 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.84 143.48 0.74 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.271 -168.541 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 9.1 t -80.79 131.08 61.5 Favored Pre-proline 0 C--O 1.245 0.85 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.399 -162.361 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.61 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 5.3 Cg_exo -68.56 -15.85 41.95 Favored 'Trans proline' 0 N--CA 1.484 0.951 0 C-N-CA 123.277 2.651 . . . . 0.0 113.372 168.39 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.37 -71.41 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.384 -167.743 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.6 p -91.53 -23.02 20.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.474 -162.249 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 t0 73.71 57.34 0.1 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.535 -166.444 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 174.68 8.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.971 158.556 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.14 150.5 20.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.701 168.205 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.919 HG22 ' CD2' ' A' ' 24' ' ' HIS . 55.6 t -111.4 113.63 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 114.955 -1.02 . . . . 0.0 109.829 -164.286 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 12' ' ' PHE . 60.7 t80 -66.11 170.06 6.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.421 177.278 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.493 ' N ' ' CD2' ' A' ' 11' ' ' TYR . 38.3 m-85 -61.89 -82.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.515 -169.347 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.74 -10.96 60.37 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.758 -162.598 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -103.8 44.49 1.02 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.06 168.848 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -109.7 151.49 26.84 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.444 171.117 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.468 HG21 HD22 ' A' ' 28' ' ' LEU . 17.5 m -136.66 147.54 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.863 160.165 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 m -116.22 135.31 54.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.443 -166.783 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.459 ' C ' HD22 ' A' ' 19' ' ' LEU . 13.7 t -178.17 123.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -171.156 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.9 mm? 60.26 32.42 20.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.423 -171.029 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.28 18.72 65.52 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 162.883 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.55 128.26 19.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 166.377 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.46 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 0.6 OUTLIER -69.77 177.75 2.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.367 -164.286 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.61 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.7 m95 -146.49 178.22 8.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.614 -176.253 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.919 ' CD2' HG22 ' A' ' 10' ' ' VAL . 45.7 m80 -98.79 140.22 33.3 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 114.075 -1.421 . . . . 0.0 110.494 169.035 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.588 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.38 -46.67 94.87 Favored Pre-proline 0 CA--C 1.544 0.73 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.848 -172.103 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 11.8 Cg_exo -48.78 -37.26 35.27 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 122.713 2.275 . . . . 0.0 113.486 167.781 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.45 -58.79 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.359 -165.389 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.808 HD21 ' NE2' ' A' ' 42' ' ' HIS . 2.0 tp -60.54 89.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.368 -164.575 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 mtmt -128.99 177.03 7.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.112 168.482 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.9 t -59.82 166.6 2.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.401 169.057 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -131.33 25.51 4.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.766 162.006 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 32' ' ' LYS . 1.1 tppm? -114.19 -63.59 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.324 169.147 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.7 p -92.05 -42.02 10.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.493 -165.333 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.2 62.5 0.81 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 -171.128 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -132.87 144.9 50.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.469 173.972 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.97 143.68 50.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.497 170.053 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HB3' ' CG ' ' A' ' 42' ' ' HIS . 88.0 mt -109.08 -168.22 1.31 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.437 -169.412 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.8 170.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.249 -167.385 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.01 18.5 11.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.423 -175.716 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.62 50.61 0.06 OUTLIER Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 162.8 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 58.34 54.1 40.41 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 156.515 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.808 ' NE2' HD21 ' A' ' 28' ' ' LEU . 15.7 p80 -60.43 -170.7 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.029 -0.585 . . . . 0.0 110.586 178.25 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB1' ' CE1' ' A' ' 56' ' ' TYR . . . -135.63 175.69 9.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.404 -177.672 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 49' ' ' PRO . 0.7 OUTLIER -160.49 141.49 11.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.068 166.117 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.495 ' ND1' ' CD1' ' A' ' 50' ' ' TYR . 2.8 m80 -88.79 -42.16 12.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.388 -166.695 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.49 47.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.043 -171.31 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 21.59 53.59 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 -177.473 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -141.18 96.04 7.28 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 170.852 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 44' ' ' GLU . 12.2 Cg_endo -62.97 144.49 93.19 Favored 'Trans proline' 0 N--CA 1.485 0.99 0 C-N-CA 122.714 2.276 . . . . 0.0 113.66 -170.217 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 1.3 m-85 -126.62 -174.12 3.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 169.969 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 64.3 m -59.2 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.123 -1.398 . . . . 0.0 110.511 169.297 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -110.47 -32.68 6.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.74 158.404 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 11.5 m-70 -145.23 175.01 2.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.365 162.647 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 21.7 Cg_endo -59.76 -15.66 2.49 Favored 'Cis proline' 0 N--CA 1.5 1.868 0 C-N-CA 120.651 -2.645 . . . . 0.0 112.331 -25.354 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.8 m -59.14 -50.61 73.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.798 -160.278 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.591 ' CE1' ' HB1' ' A' ' 43' ' ' ALA . 11.0 t80 -69.14 -41.21 77.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.462 -172.139 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.44 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 26.9 t -68.9 -21.35 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.415 179.785 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.48 98.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.29 -171.684 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.6 mmt -86.75 -42.58 13.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.418 169.433 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -95.26 101.92 13.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.36 -168.587 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.96 -104.97 0.19 Allowed Glycine 0 CA--C 1.543 1.828 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 170.471 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -56.05 -155.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.486 1.069 0 C-N-CA 122.473 2.115 . . . . 0.0 113.431 171.322 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.31 86.98 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 168.823 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.24 -142.52 3.54 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.437 -1.065 . . . . 0.0 110.437 -170.078 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 65.46 -77.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.423 -0.388 . . . . 0.0 110.366 -169.721 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.57 -144.89 14.91 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 169.493 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -177.83 139.6 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.353 -0.423 . . . . 0.0 110.367 169.917 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.0 39.35 2.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 -178.966 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -130.95 70.52 0.52 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 -170.082 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.44 118.45 20.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.212 -170.34 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 59.07 -79.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.623 175.667 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.5 t -135.95 -84.38 0.38 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.476 -178.21 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 61.54 175.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.399 169.808 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.7 t -79.32 -22.94 43.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.369 -170.307 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -68.17 144.95 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.377 -169.993 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.583 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.321 -170.092 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.416 ' HA ' ' OD1' ' A' ' 22' ' ' ASP . 10.1 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -61.01 146.93 45.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.344 -167.402 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.543 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 22.9 t -79.93 129.36 70.77 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.383 -163.86 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.612 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.3 Cg_endo -67.88 -18.65 46.93 Favored 'Trans proline' 0 N--CA 1.485 0.999 0 C-N-CA 123.25 2.634 . . . . 0.0 113.497 169.088 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -68.61 0.78 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.251 -166.335 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 p -94.77 -24.42 17.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.479 -163.358 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t70 73.65 65.88 0.09 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.47 -165.767 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -129.04 -168.47 1.93 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.927 159.573 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.42 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -107.49 147.08 30.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.207 163.52 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.931 HG22 ' CD2' ' A' ' 24' ' ' HIS . 50.3 t -105.59 116.47 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.767 -163.741 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -166.85 0.65 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.289 -178.889 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.91 -83.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.48 -167.67 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.83 -12.47 61.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.726 -159.081 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -94.44 17.13 13.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.199 179.894 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.1 ptt-85 -88.53 149.24 23.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.329 -168.249 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 m -148.25 119.54 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.067 161.66 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 42.9 m -93.03 137.16 32.63 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.397 -174.792 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.488 ' C ' HD22 ' A' ' 19' ' ' LEU . 2.0 t -174.33 129.68 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.276 -168.815 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.641 HD22 ' N ' ' A' ' 19' ' ' LEU . 1.8 mm? 59.98 31.85 20.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.571 -171.781 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.73 18.6 61.91 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 166.272 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -147.29 122.57 10.26 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 164.553 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 17' ' ' THR . 0.6 OUTLIER -63.25 -179.82 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.381 -162.011 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.612 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 44.6 m95 -145.78 178.25 8.3 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.742 -178.015 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.931 ' CD2' HG22 ' A' ' 10' ' ' VAL . 48.2 m80 -98.24 146.53 25.54 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.202 -1.363 . . . . 0.0 110.51 171.055 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 9.4 tpt180 -62.04 -47.36 90.96 Favored Pre-proline 0 CA--C 1.543 0.673 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.719 -171.949 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 9.1 Cg_endo -62.85 -28.34 75.62 Favored 'Trans proline' 0 N--CA 1.484 0.961 0 C-N-CA 122.491 2.127 . . . . 0.0 113.531 176.915 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.23 -49.43 19.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.136 -165.743 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.825 HD21 ' NE2' ' A' ' 42' ' ' HIS . 0.7 OUTLIER -73.03 94.55 1.9 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.341 -160.449 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.34 170.04 15.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.075 163.719 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -60.06 -174.89 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.318 172.144 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -144.65 22.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.65 157.327 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.02 -33.04 1.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.553 -165.106 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.5 p -110.7 -53.01 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.504 163.999 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.24 68.23 0.61 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -169.114 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -144.18 162.69 35.68 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.024 -0.588 . . . . 0.0 110.449 -178.778 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.07 156.49 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.424 169.88 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' A' ' 42' ' ' HIS . 5.8 mt -129.53 173.84 10.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.261 -166.851 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.565 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.21 -162.43 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.351 -160.394 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.565 ' H ' HG22 ' A' ' 38' ' ' THR . 2.9 p -61.08 -85.44 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.424 -177.863 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.33 48.36 1.03 Allowed Glycine 0 CA--C 1.539 1.543 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 159.498 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.82 -105.85 0.01 OUTLIER Glycine 0 CA--C 1.533 1.162 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 152.443 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.886 ' HB3' HD22 ' A' ' 37' ' ' LEU . 4.3 p80 -58.74 -170.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.862 -0.669 . . . . 0.0 110.806 -163.675 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.579 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -125.55 -166.9 1.61 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.96 160.965 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.498 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -135.73 146.44 47.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.071 -176.31 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.5 ' CD2' ' CZ ' ' A' ' 60' ' ' PHE . 85.6 t60 -147.48 112.1 5.32 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.759 178.589 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.423 ' HB2' ' CD2' ' A' ' 45' ' ' HIS . 0.7 OUTLIER 58.65 43.1 19.42 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.603 167.739 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.92 46.13 18.24 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 165.629 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 pttt 176.26 97.3 0.1 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -178.184 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.8 144.08 96.62 Favored 'Trans proline' 0 N--CA 1.484 0.955 0 C-N-CA 122.936 2.424 . . . . 0.0 113.555 -167.562 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 0.9 OUTLIER -131.55 171.18 13.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.728 161.973 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 55.8 m -58.62 145.45 39.6 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 113.836 -1.529 . . . . 0.0 110.81 174.646 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.25 -34.92 75.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 114.383 -1.28 . . . . 0.0 110.369 175.291 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 42.1 m-70 -163.07 165.22 15.04 Favored Pre-proline 0 CA--C 1.549 0.909 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.529 166.729 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.5 Cg_endo -69.89 -6.08 9.43 Favored 'Cis proline' 0 N--CA 1.483 0.881 0 C-N-CA 122.594 -1.836 . . . . 0.0 113.689 -11.523 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 93.2 m -60.37 -50.37 73.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.577 -161.693 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -62.03 -37.86 86.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.351 -172.307 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.438 ' CB ' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -107.24 29.28 7.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.474 175.751 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . -84.21 -68.79 0.69 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.365 171.212 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.0 ttt -86.87 -37.55 17.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.397 -168.569 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.5 ' CZ ' ' CD2' ' A' ' 45' ' ' HIS . 28.6 m-85 -67.64 83.74 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.445 -169.264 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -140.57 -165.79 10.43 Favored Glycine 0 CA--C 1.544 1.885 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -173.818 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -56.4 -57.58 1.37 Allowed 'Trans proline' 0 N--CA 1.484 0.935 0 C-N-CA 122.461 2.107 . . . . 0.0 113.597 -173.964 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.1 mtmp? -66.32 134.18 52.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.407 -169.968 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.7 -151.46 8.81 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 170.609 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' CD2' ' N ' ' A' ' 66' ' ' GLY . 52.8 p90 -96.61 -50.66 4.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.29 -0.455 . . . . 0.0 110.334 170.117 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.482 ' N ' ' CD2' ' A' ' 65' ' ' PHE . . . -147.33 -86.49 0.06 OUTLIER Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 170.284 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 65.25 167.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.333 -0.433 . . . . 0.0 110.295 170.271 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.34 133.08 0.06 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 170.613 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -138.25 25.13 2.91 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 170.459 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.27 -82.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.121 -0.539 . . . . 0.0 110.39 172.128 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -169.64 -177.89 2.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.978 -168.667 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 t -107.43 -80.21 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.341 169.329 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.6 p80 175.12 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.403 170.074 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.89 -74.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.484 170.1 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.14 158.33 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.383 -177.24 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.392 -170.049 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.484 0.955 0 N-CA-C 113.494 0.536 . . . . 0.0 113.494 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 15.3 tttt 65.2 153.58 0.06 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.47 165.903 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 15.1 t -72.41 128.61 88.47 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.584 -166.663 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.609 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 3.7 Cg_exo -69.99 -7.86 22.17 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.363 2.708 . . . . 0.0 113.39 168.946 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -70.86 0.71 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.276 -173.648 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.1 p -97.03 -21.73 17.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.656 -161.152 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t0 73.75 62.98 0.09 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.529 -167.897 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -140.06 166.71 23.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.895 158.947 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.499 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -85.23 152.39 23.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.836 179.609 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.932 HG22 ' NE2' ' A' ' 24' ' ' HIS . 98.8 t -124.65 125.36 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.334 -164.013 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.499 ' CE2' ' CE1' ' A' ' 12' ' ' PHE . 9.7 t80 -172.23 136.79 0.85 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -159.64 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.499 ' CE1' ' CE2' ' A' ' 11' ' ' TYR . 2.2 m-85 70.64 178.12 0.26 Allowed 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -162.677 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.27 -0.5 10.11 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.584 -155.443 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.31 -18.92 52.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.41 171.081 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.714 ' CB ' HG12 ' A' ' 10' ' ' VAL . 9.8 ptm180 -87.03 127.64 35.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.307 -168.432 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.3 m -127.85 171.33 16.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.091 166.18 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 m -127.31 137.62 52.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.452 -167.585 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 10.1 t -176.05 126.65 0.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.315 -175.746 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.679 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.0 mm? 60.22 24.59 13.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.473 -171.622 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.37 -24.76 25.89 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 162.908 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 1.5 mptp? -113.45 132.17 55.75 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.23 -178.263 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.447 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 9.1 m-20 -70.47 179.35 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.32 -163.246 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.609 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 27.2 m95 -149.63 164.8 34.17 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.732 -176.923 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.932 ' NE2' HG22 ' A' ' 10' ' ' VAL . 35.9 m80 -85.35 137.06 33.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.481 164.412 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 3.9 tpm_? -61.21 -49.45 88.16 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.817 -172.651 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.57 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 8.9 Cg_endo -58.58 -16.7 31.3 Favored 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 122.568 2.179 . . . . 0.0 113.569 174.234 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.88 -49.41 7.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.298 -177.223 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.852 HD21 ' NE2' ' A' ' 42' ' ' HIS . 1.7 tp -62.92 86.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.378 -167.226 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 11.9 mtmt -133.86 163.8 28.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.359 -178.159 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 2.1 t -64.53 157.78 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 168.157 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -126.31 24.91 6.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.997 164.366 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HE2' ' HB2' ' A' ' 58' ' ' ALA . 3.6 tttp -109.29 -64.15 1.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.198 163.01 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 p -92.8 -19.08 22.1 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.517 -165.084 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.91 53.4 3.53 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 167.554 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -143.93 147.52 34.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.058 -0.571 . . . . 0.0 110.433 179.796 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -61.49 171.64 1.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.508 176.54 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 42' ' ' HIS . 5.3 mt -133.14 176.58 8.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.285 -177.498 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -111.03 -174.68 2.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.376 -165.804 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.615 ' H ' HG22 ' A' ' 38' ' ' THR . 29.8 t -61.11 -15.5 33.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.437 -170.02 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.56 67.16 0.03 OUTLIER Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 167.519 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -122.62 11.77 8.92 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 165.775 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.852 ' NE2' HD21 ' A' ' 28' ' ' LEU . 4.6 p80 -97.2 -169.19 1.82 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.876 -0.662 . . . . 0.0 110.369 174.754 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -153.98 -165.64 2.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.246 166.32 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.434 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 20.3 tt0 -158.32 151.16 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.997 -174.821 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.531 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 8.4 p80 -93.19 16.26 13.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.562 171.216 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 58.7 72.95 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.675 -169.585 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 167.64 -41.98 0.24 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -179.634 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.85 134.3 4.31 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-O 121.494 0.664 . . . . 0.0 109.652 169.65 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.568 ' HD3' ' CZ3' ' A' ' 23' ' ' TRP . 18.9 Cg_endo -60.62 145.46 98.8 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 C-N-CA 122.42 2.08 . . . . 0.0 113.625 -178.413 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 3.0 m-85 -133.53 -164.81 1.54 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.76 162.268 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 60.1 m -59.09 -171.92 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.418 167.794 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -99.86 -31.85 11.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.12 163.186 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 49.6 m-70 -168.23 165.3 7.84 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.542 171.652 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.512 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 9.3 Cg_endo -70.44 -5.58 10.01 Favored 'Cis proline' 0 N--CA 1.481 0.781 0 C-N-CA 122.637 -1.818 . . . . 0.0 113.672 -10.789 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 65.0 m -60.07 -39.75 87.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.494 -161.412 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -67.95 -36.75 80.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.426 -170.957 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.9 p -100.25 21.04 13.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.434 174.768 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.534 ' HB2' ' HE2' ' A' ' 32' ' ' LYS . . . -60.86 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.425 172.12 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.1 ttp -129.41 -25.63 2.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.438 -169.202 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.531 ' CE2' ' HB3' ' A' ' 45' ' ' HIS . 23.7 m-85 -74.58 102.6 4.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.359 -168.162 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.16 31.32 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -172.54 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -57.96 129.15 31.84 Favored 'Trans proline' 0 N--CA 1.485 0.982 0 C-N-CA 122.57 2.18 . . . . 0.0 113.519 -173.488 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? 178.6 -72.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.321 169.472 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.18 -171.81 39.01 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 170.357 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -151.65 122.33 7.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.278 -0.461 . . . . 0.0 110.382 170.05 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -153.09 -113.31 0.53 Allowed Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 170.179 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.08 125.88 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.369 170.119 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.22 -139.86 14.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -170.187 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -124.03 -129.53 3.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 170.261 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -173.12 -163.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.409 -0.396 . . . . 0.0 110.281 -169.939 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 58.48 29.87 18.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.603 -168.767 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.64 101.96 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.374 169.375 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -100.45 -70.01 0.75 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.402 169.986 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -146.93 -61.47 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.363 -177.87 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 65.62 146.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.318 -169.891 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.239 0.518 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.347 -170.222 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.486 1.061 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.582 ' HG2' ' HB3' ' A' ' 9' ' ' GLU . 16.5 mtpt 61.94 167.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.379 168.837 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 13.5 t -80.28 127.36 76.61 Favored Pre-proline 0 C--O 1.244 0.815 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.457 -164.224 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CE2' ' A' ' 23' ' ' TRP . 3.1 Cg_exo -67.07 -13.86 41.34 Favored 'Trans proline' 0 N--CA 1.485 1.025 0 C-N-CA 123.228 2.619 . . . . 0.0 113.465 167.447 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.45 -73.11 0.59 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.41 -172.245 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.6 p -91.44 -13.42 32.33 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.479 -168.202 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.1 p30 59.11 56.96 3.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.655 -167.99 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 24' ' ' HIS . 2.5 tttt -110.17 -167.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.965 158.925 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.582 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -107.86 149.57 28.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.263 162.863 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.93 HG22 ' CD2' ' A' ' 24' ' ' HIS . 66.1 t -111.13 113.84 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.921 -166.9 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.07 -168.61 1.32 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.365 175.78 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -72.43 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.451 -165.446 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.77 -1.14 8.41 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.036 -0.666 . . . . 0.0 111.62 -161.076 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.4 17.53 23.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.386 178.348 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 151.97 19.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.311 -165.079 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.813 HG21 HD22 ' A' ' 28' ' ' LEU . 18.2 m -147.98 145.37 18.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.916 160.151 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 28.2 m -118.9 134.83 54.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.378 -167.56 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.45 ' CB ' ' CE1' ' A' ' 42' ' ' HIS . 20.7 t -178.18 131.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.316 -169.87 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.1 mm? 60.19 20.65 10.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.454 -169.435 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.68 -24.39 28.2 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 165.438 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.39 141.66 45.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.843 -0.678 . . . . 0.0 110.224 -177.593 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.4 177.01 9.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.394 -164.562 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CE2' ' HG2' ' A' ' 4' ' ' PRO . 30.6 m95 -146.95 179.67 7.44 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.665 -176.181 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.93 ' CD2' HG22 ' A' ' 10' ' ' VAL . 38.4 m80 -100.07 136.56 39.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.468 165.424 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HD3' HG11 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -67.77 -47.09 44.8 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.85 -172.121 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 12.7 Cg_exo -47.72 -38.71 29.89 Favored 'Trans proline' 0 N--CA 1.485 1.006 0 C-N-CA 122.711 2.274 . . . . 0.0 113.46 166.525 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 m -68.05 -56.41 8.99 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.255 -178.393 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.98 HD21 ' CD2' ' A' ' 42' ' ' HIS . 5.7 tp -60.46 89.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.37 -163.768 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HA ' ' HG ' ' A' ' 37' ' ' LEU . 3.0 pttt -132.4 160.01 37.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.36 171.773 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.2 t -60.74 158.69 12.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.276 167.239 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 23.5 pt-20 -134.44 23.55 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.577 159.043 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -36.62 5.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.505 -179.764 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.6 -52.62 2.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.463 164.838 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 114.56 57.86 0.37 Allowed Glycine 0 CA--C 1.528 0.852 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 172.027 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -136.82 143.1 42.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.412 168.836 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -61.77 157.59 17.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.475 175.206 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.81 HD13 ' HB2' ' A' ' 42' ' ' HIS . 6.6 mt -116.19 -173.09 2.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.342 -171.013 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -115.31 -176.72 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.341 -167.363 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.59 ' H ' HG22 ' A' ' 38' ' ' THR . 28.2 p -61.58 -21.39 64.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.387 -168.513 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.04 53.63 0.06 OUTLIER Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 170.728 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.49 10.58 14.44 Favored Glycine 0 CA--C 1.522 0.475 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 167.099 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.98 ' CD2' HD21 ' A' ' 28' ' ' LEU . 6.7 p80 -86.57 -170.0 2.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.231 -0.485 . . . . 0.0 110.386 174.629 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 51' ' ' CYS . . . -154.45 -168.97 3.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.142 166.687 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.7 152.88 3.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.947 -168.45 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.438 ' CB ' ' CE2' ' A' ' 60' ' ' PHE . 85.5 t60 -130.87 73.52 1.55 Allowed 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.97 179.731 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.48 83.63 0.12 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.916 -176.465 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.36 45.93 66.52 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 167.397 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.34 90.11 0.51 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 121.538 0.685 . . . . 0.0 109.845 169.838 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.89 145.25 99.32 Favored 'Trans proline' 0 N--CA 1.485 1.023 0 C-N-CA 122.514 2.143 . . . . 0.0 113.691 -178.318 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 54.1 m-85 -144.48 -159.8 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.906 167.888 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 36.4 m -55.39 179.61 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.26 170.886 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -105.15 -29.42 10.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.605 157.66 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 26.1 m-70 -155.38 166.14 16.84 Favored Pre-proline 0 CA--C 1.55 0.956 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.276 164.923 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.9 Cg_endo -69.83 -14.69 12.63 Favored 'Cis proline' 0 N--CA 1.482 0.81 0 C-N-CA 122.41 -1.912 . . . . 0.0 113.654 -13.629 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 61.7 m -59.85 -49.56 77.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.511 -160.032 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.84 -48.73 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.265 -170.812 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.492 ' HG ' ' CE1' ' A' ' 53' ' ' HIS . 6.8 m -72.89 -18.74 61.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.383 -174.471 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.98 -59.65 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.264 -170.289 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.9 mmt -65.83 -37.11 85.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.398 -169.924 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.438 ' CE2' ' CB ' ' A' ' 45' ' ' HIS . 28.8 m-85 -93.33 85.24 4.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.377 176.47 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.25 -172.52 23.24 Favored Glycine 0 CA--C 1.544 1.904 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -172.766 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.599 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 6.9 Cg_endo -58.07 -79.66 0.02 OUTLIER 'Trans proline' 0 N--CA 1.484 0.958 0 C-N-CA 122.503 2.135 . . . . 0.0 113.548 -173.567 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.599 ' HD3' ' HB2' ' A' ' 62' ' ' PRO . 2.1 mppt? -138.52 -77.02 0.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.294 -0.867 . . . . 0.0 110.343 -169.508 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.31 -34.34 2.62 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -170.001 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -168.83 -64.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.409 -0.395 . . . . 0.0 110.345 169.925 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 145.1 84.76 0.06 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 170.177 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 mtt-85 61.02 24.88 14.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.431 -0.384 . . . . 0.0 110.424 170.154 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -39.35 2.84 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -178.718 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.46 -77.69 0.23 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.601 -0.999 . . . . 0.0 110.601 -170.12 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.07 -171.72 2.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.254 -0.473 . . . . 0.0 110.274 175.578 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -50.09 67.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.963 -168.897 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -148.93 111.91 4.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.376 169.336 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -67.43 111.51 4.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.342 -169.935 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.58 HG23 ' H ' ' A' ' 75' ' ' PHE . 4.5 t -167.74 -61.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.425 170.041 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.58 ' H ' HG23 ' A' ' 74' ' ' THR . 0.2 OUTLIER -151.79 -57.27 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.374 176.817 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.559 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.276 170.021 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.613 ' HA ' ' HB2' ' A' ' 22' ' ' ASP . 21.7 Cg_exo . . . . . 0 N--CA 1.485 0.982 0 N-CA-C 113.569 0.565 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER 66.12 125.84 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.672 165.605 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 21.7 t -93.96 120.83 65.36 Favored Pre-proline 0 C--O 1.245 0.829 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.575 -168.44 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.596 ' HD2' ' CD2' ' A' ' 23' ' ' TRP . 4.3 Cg_exo -75.97 -5.66 16.58 Favored 'Trans proline' 0 N--CA 1.483 0.856 0 C-N-CA 123.201 2.601 . . . . 0.0 113.818 173.628 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.527 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -90.94 -78.65 0.38 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.573 -179.719 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.7 p -77.04 -23.21 52.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.501 -173.016 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 71.89 47.7 0.31 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.475 -173.762 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.7 -168.91 1.61 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.829 159.277 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -108.67 154.65 21.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.708 160.975 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' A' ' 24' ' ' HIS . 54.1 t -114.94 115.36 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.403 -162.894 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -92.17 55.09 2.5 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.852 -156.942 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 67.54 -79.99 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.594 173.668 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.07 0.11 25.91 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.383 -162.48 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -107.0 12.69 28.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.254 175.954 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.05 26.06 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.271 -163.083 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.647 ' CG2' HD22 ' A' ' 28' ' ' LEU . 15.8 m -148.27 121.89 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.843 158.265 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 90.1 m -97.48 136.72 37.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.414 -161.659 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' HD22 ' A' ' 19' ' ' LEU . 23.0 t -178.2 137.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.428 -167.799 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.613 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.7 mm? 60.04 22.11 11.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.625 -171.248 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.05 -23.14 22.31 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 168.797 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 21' ' ' LYS . 14.8 mmmt -122.31 126.73 48.72 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 114.739 -0.731 . . . . 0.0 110.021 -176.634 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.613 ' HB2' ' HA ' ' A' ' 1' ' ' PRO . 0.6 OUTLIER -60.43 -175.47 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.365 -160.995 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.596 ' CD2' ' HD2' ' A' ' 4' ' ' PRO . 72.5 m95 -146.49 -172.79 4.03 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 112.892 -1.958 . . . . 0.0 109.501 179.127 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.915 ' CD2' HG22 ' A' ' 10' ' ' VAL . 47.0 m80 -100.75 153.01 19.81 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.612 165.211 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' CB ' ' HD3' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -69.22 -63.85 1.89 Allowed Pre-proline 0 CA--C 1.542 0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.788 179.943 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 25' ' ' ARG . 3.7 Cg_exo -50.84 -17.56 3.37 Favored 'Trans proline' 0 N--CA 1.485 1.013 0 C-N-CA 122.301 2.001 . . . . 0.0 113.455 177.337 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 24' ' ' HIS . 1.7 m -80.99 -52.89 6.94 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.394 178.692 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.902 HD11 ' CE1' ' A' ' 42' ' ' HIS . 2.9 tp -72.98 82.84 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.319 -163.952 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -138.45 172.07 13.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.304 167.931 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.7 t -67.97 157.68 34.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.357 174.297 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.36 23.67 5.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.749 161.399 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.417 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -116.95 -41.36 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.471 -171.45 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -110.98 -52.44 2.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.782 173.264 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.05 59.01 0.25 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 173.076 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.0 mtpp -149.07 168.28 23.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.408 -177.568 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' LEU . 8.0 m -92.87 168.05 11.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.381 -178.78 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.745 HD13 ' CB ' ' A' ' 42' ' ' HIS . 4.1 mt -131.65 131.45 43.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.419 -167.563 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -155.91 -170.15 3.31 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.232 173.014 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.507 ' H ' HG22 ' A' ' 38' ' ' THR . 0.5 OUTLIER 63.42 14.74 8.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.026 -163.45 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.31 45.89 95.3 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 -162.734 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -94.13 9.9 72.13 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 -163.385 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.902 ' CE1' HD11 ' A' ' 28' ' ' LEU . 3.5 p80 -106.32 -171.6 1.93 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.142 0.496 . . . . 0.0 110.545 -173.656 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -176.37 159.63 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.134 175.74 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.423 ' HG2' HD11 ' A' ' 19' ' ' LEU . 1.1 pt-20 -109.47 140.7 42.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.961 -165.134 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.491 ' CE1' ' CD1' ' A' ' 60' ' ' PHE . 43.3 t60 -94.41 41.22 1.09 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.797 1.284 . . . . 0.0 109.506 161.89 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 58.5 98.78 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.622 -171.833 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.22 37.22 43.03 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 168.4 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mttt 179.95 96.31 0.19 Allowed Pre-proline 0 CA--C 1.543 0.684 0 CA-C-O 121.238 0.542 . . . . 0.0 109.724 172.892 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -63.52 146.5 92.94 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 C-N-CA 122.754 2.302 . . . . 0.0 113.546 -173.521 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' CYS . 26.8 m-85 -145.13 -162.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.938 166.411 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 82.7 m -57.52 179.45 0.06 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.724 167.925 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.54 -27.56 12.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.066 161.426 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.535 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 44.8 m-70 -164.83 166.99 10.47 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.464 170.178 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.674 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 11.5 Cg_endo -68.69 -7.94 8.47 Favored 'Cis proline' 0 N--CA 1.482 0.834 0 C-N-CA 122.513 -1.87 . . . . 0.0 113.702 -12.693 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' CYS . 70.1 m -60.48 -52.71 64.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.417 -162.461 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -60.72 -33.37 72.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.394 -168.366 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.507 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.9 OUTLIER -112.08 26.78 10.26 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.322 179.97 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 54' ' ' PRO . . . -94.79 -66.73 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.323 178.783 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 32.7 mtt -107.87 -27.89 9.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.396 -167.548 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.491 ' CD1' ' CE1' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -75.06 90.37 2.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.321 -170.154 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 177.62 72.72 0.06 OUTLIER Glycine 0 CA--C 1.544 1.88 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 -172.559 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -56.98 -53.89 4.4 Favored 'Trans proline' 0 N--CA 1.484 0.96 0 C-N-CA 122.518 2.145 . . . . 0.0 113.545 -172.223 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.41 -77.48 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.361 -169.004 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.27 156.64 26.81 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 170.094 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -126.39 -177.48 4.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.384 -0.408 . . . . 0.0 110.344 170.059 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -141.21 111.56 0.72 Allowed Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -170.09 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.75 32.88 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.338 -0.431 . . . . 0.0 110.371 169.959 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 150.99 44.27 0.02 OUTLIER Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 -178.869 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -119.28 83.63 0.36 Allowed Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 170.286 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -147.64 21.48 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.358 -0.421 . . . . 0.0 110.359 169.857 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.8 -53.3 57.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.992 -168.78 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -155.08 -41.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.382 174.329 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 58.0 m80 66.09 25.44 10.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.391 -169.696 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 22.6 p -60.82 -86.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.42 170.261 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -105.73 -75.99 0.62 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.294 -0.867 . . . . 0.0 110.348 -169.858 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.58 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.38 178.407 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.418 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 11.9 Cg_endo . . . . . 0 N--CA 1.486 1.04 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 160.89 30.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.406 -168.57 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HB2' ' CE1' ' A' ' 24' ' ' HIS . 10.2 t -81.15 130.82 61.29 Favored Pre-proline 0 C--O 1.246 0.872 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.461 -162.689 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.614 ' HG2' ' CZ2' ' A' ' 23' ' ' TRP . 2.7 Cg_endo -69.08 -18.13 40.33 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 C-N-CA 123.379 2.719 . . . . 0.0 113.368 166.908 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 -70.9 0.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.381 -167.301 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.1 p -91.65 -24.17 19.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.432 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 73.03 54.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.505 -167.609 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 8' ' ' LYS . 4.2 tptp -112.64 -169.27 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.822 158.409 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -109.52 150.97 27.37 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.526 161.386 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.937 HG22 ' CD2' ' A' ' 24' ' ' HIS . 53.9 t -107.74 114.9 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.63 -165.439 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -101.36 56.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.023 0.915 . . . . 0.0 110.079 -158.906 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.27 -80.59 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.354 170.8 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.02 -6.37 56.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.414 -157.615 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -114.09 41.66 2.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.082 163.502 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -86.45 149.16 25.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.367 177.758 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.429 ' CG2' ' HB2' ' A' ' 23' ' ' TRP . 16.2 m -147.12 122.4 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.623 158.392 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.6 m -100.02 136.89 39.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.399 -162.252 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.491 ' HB3' ' NE1' ' A' ' 23' ' ' TRP . 23.7 t -177.67 127.18 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.307 -166.361 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 19' ' ' LEU . 2.6 mm? 60.12 29.79 19.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.699 -171.758 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.51 17.19 47.17 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 167.57 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.24 119.33 12.75 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 164.903 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.418 ' OD2' ' HB3' ' A' ' 1' ' ' PRO . 17.4 m-20 -62.03 -178.21 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.396 -159.291 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.614 ' CZ2' ' HG2' ' A' ' 4' ' ' PRO . 51.2 m95 -146.47 -174.41 4.45 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 113.838 -1.528 . . . . 0.0 109.473 179.42 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.937 ' CD2' HG22 ' A' ' 10' ' ' VAL . 46.3 m80 -100.57 154.61 18.43 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.59 172.021 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.547 ' HB3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.84 -56.75 29.26 Favored Pre-proline 0 C--O 1.241 0.634 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.851 -173.851 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HD3' ' HB3' ' A' ' 25' ' ' ARG . 5.8 Cg_exo -64.01 -27.87 66.09 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 122.695 2.263 . . . . 0.0 113.545 -179.178 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -69.95 -53.49 17.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.218 -166.453 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.911 HD21 ' CD2' ' A' ' 42' ' ' HIS . 2.2 tp -60.04 100.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.434 -159.082 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.446 ' H ' ' HG2' ' A' ' 49' ' ' PRO . 4.5 mttt -132.64 147.28 52.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.217 -170.037 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 1.8 t -59.79 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.337 168.554 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HB3' ' CE2' ' A' ' 50' ' ' TYR . 4.9 tt0 -146.47 25.41 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.753 157.722 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.11 -38.34 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.522 -169.045 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 26.1 p -104.88 -31.59 9.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.32 165.19 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.84 56.15 1.9 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 160.439 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.61 175.36 3.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.369 161.416 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.622 HG22 ' H ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -60.39 179.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.44 -162.095 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.756 HD13 ' HB3' ' A' ' 42' ' ' HIS . 6.8 mt -131.73 -172.18 2.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.3 -173.973 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 92.1 m -123.95 137.82 54.56 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 -176.025 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 t 59.69 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.558 165.372 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.58 44.1 0.18 Allowed Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 160.224 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.08 11.08 56.35 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.878 -0.661 . . . . 0.0 111.553 -175.705 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.911 ' CD2' HD21 ' A' ' 28' ' ' LEU . 8.1 p80 -90.56 -169.49 2.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.897 -0.651 . . . . 0.0 110.39 172.041 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 19' ' ' LEU . . . -154.27 154.45 33.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.14 166.837 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.505 ' HG2' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -100.3 146.92 26.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.155 -178.742 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.499 ' CG ' ' CZ ' ' A' ' 60' ' ' PHE . 86.1 t60 -87.7 -45.88 9.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.813 166.1 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.82 79.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.009 166.264 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.78 -23.29 33.45 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 175.077 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 97.79 25.38 Favored Pre-proline 0 C--O 1.244 0.776 0 CA-C-N 115.003 -0.599 . . . . 0.0 109.697 -173.976 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.446 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 16.0 Cg_endo -65.77 142.05 68.26 Favored 'Trans proline' 0 N--CA 1.485 0.973 0 C-N-CA 122.629 2.219 . . . . 0.0 113.711 -170.161 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 31' ' ' GLU . 1.9 m-85 -135.41 167.29 21.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.399 163.486 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 42.9 m -59.53 153.7 19.04 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 113.725 -1.58 . . . . 0.0 110.448 172.741 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -61.81 -45.91 91.79 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.321 179.001 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 54' ' ' PRO . 28.5 m-70 -158.36 163.58 23.96 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.517 169.025 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' HIS . 10.5 Cg_endo -71.49 -3.8 10.76 Favored 'Cis proline' 0 N--CA 1.483 0.891 0 C-N-CA 122.748 -1.772 . . . . 0.0 113.817 -9.168 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 88.3 m -60.06 -59.16 5.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.407 -160.982 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -60.63 -40.74 93.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.454 -169.301 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.52 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . 13.3 p -64.81 -21.29 66.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.422 176.835 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 55' ' ' CYS . . . -66.28 -44.31 83.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.228 -169.149 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -91.57 -49.02 6.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.439 168.399 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.499 ' CZ ' ' CG ' ' A' ' 45' ' ' HIS . 8.0 m-85 -119.8 81.94 1.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.277 -171.634 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.471 ' HA2' ' HA ' ' A' ' 57' ' ' SER . . . -118.74 141.1 15.75 Favored Glycine 0 CA--C 1.543 1.822 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -170.261 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.97 -33.24 96.93 Favored 'Trans proline' 0 N--CA 1.482 0.85 0 C-N-CA 122.601 2.2 . . . . 0.0 113.652 172.488 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -82.02 -57.78 3.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.289 -169.136 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.87 95.39 0.09 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.959 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.7 p90 56.82 83.71 0.1 Allowed 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 122.188 -0.595 . . . . 0.0 111.844 177.251 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -143.83 73.11 0.35 Allowed Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 175.512 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -143.99 -73.35 0.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.416 -0.392 . . . . 0.0 110.427 170.012 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -154.68 -174.37 24.6 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -170.613 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.82 -58.84 0.03 OUTLIER Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 -170.406 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.7 147.99 47.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.347 -0.427 . . . . 0.0 110.201 -169.954 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -164.33 122.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.113 169.009 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 m -78.52 -83.89 0.08 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.38 -169.385 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.21 145.92 52.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.393 -170.046 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.95 -55.53 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.427 170.133 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -138.84 -79.38 0.33 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.341 169.939 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.645 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.419 178.443 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 77' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_